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"2h6o_96_4054", "State": "Validated", "Flags": [ "Analyzed", "Missing", "Missing_Atoms" ], "MainResidue": "NAG 1 Z", "ResidueCount": 1, "Residues": [ "NAG 1 Z" ], "MissingAtomCount": 1, "MissingRingCount": 0, "WrongBondCount": 0, "HasBondDiscrepancy": false, "NameMismatchCount": 0, "ForeignAtomCount": 0, "ChiralityMismatchCount": 0, "SubstitutionCount": 0, "UnmatchedMotiveAtomCount": 3, "MissingAtoms": [ 10 ], "MissingRings": "", "WrongBonds": [], "NameMismatches": {}, "NameMismatchFlags": {}, "ForeignAtoms": {}, "ChiralityMismatches": {}, "Substitutions": {}, "AlternateLocationCount": 0, "DuplicateNames": [], "NonBoundarySubstitutionAndForeignAtoms": [], "UnmatchedModelNames": [ "O1" ], "ModelRmsd": 0.412 }, { "ModelName": "NAG", "Id": "2h6o_97_4068", "State": "Validated", "Flags": [ "Analyzed", "HasAll", "HasAll_Foreign", "HasAll_GoodChirality", "HasAll_GoodChirality_IgnorePlanarAndNonSingleBondErrors" ], "MainResidue": "NAG 2 Z", "ResidueCount": 2, "Residues": [ "NAG 1 Z", "NAG 2 Z" 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"10": "O", "11": "O", "12": "O" }, "PlanarAtoms": [], "ChiralAtoms": [ 1, 2, 3, 4, 5 ], "ChiralAtomsInfo": { "Planar": [], "Carbon": [ 1, 2, 3, 4, 5 ], "Metal": [], "NonSingleBond": [] }, "AtomNamingEquivalence": { "Charge": { "H61": "H61", "H62": "H61", "H4": "H4", "H5": "H4", "HO3": "HO3", "HO4": "HO3" }, "ChargeIgnoreBondTypes": { "O4": "O4", "O6": "O4" } }, "ModelBonds": { "1-2": 1, "1-7": 1, "1-11": 1, "2-3": 1, "2-8": 1, "3-4": 1, "3-9": 1, "4-5": 1, "4-10": 1, "5-6": 1, "5-11": 1, "6-12": 1 }, "Summary": { "Analyzed": 57, "HasAll": 53, "HasAll_BadChirality": 24, "HasAll_BadChirality_Carbon": 24, "HasAll_BadChirality_Metal": 0, "HasAll_BadChirality_NonSingleBond": 0, "HasAll_BadChirality_Other": 0, "HasAll_BadChirality_Planar": 0, "HasAll_Foreign": 53, "HasAll_GoodChirality": 29, "HasAll_GoodChirality_IgnorePlanarAndNonSingleBondErrors": 29, "HasAll_NameMismatch": 0, "HasAll_NameMismatch_ChargeEquiv": 0, "HasAll_NameMismatch_ChargeEquivIgnoreBondType": 0, 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"UnmatchedModelNames": [ "O1" ], "ModelRmsd": 0.717 }, { "ModelName": "MAN", "Id": "2h6o_18_4248", "State": "Validated", "Flags": [ "Analyzed", "HasAll", "HasAll_BadChirality", "HasAll_BadChirality_Carbon", "HasAll_Foreign" ], "MainResidue": "MAN 4 d", "ResidueCount": 2, "Residues": [ "MAN 3 d", "MAN 4 d" ], "MissingAtomCount": 0, "MissingRingCount": 0, "WrongBondCount": 0, "HasBondDiscrepancy": false, "NameMismatchCount": 0, "ForeignAtomCount": 1, "ChiralityMismatchCount": 1, "SubstitutionCount": 0, "UnmatchedMotiveAtomCount": 4, "MissingAtoms": [], "MissingRings": "", "WrongBonds": [], "NameMismatches": {}, "NameMismatchFlags": {}, "ForeignAtoms": { "7": "O3 O 4244, MAN 3 d" }, "ChiralityMismatches": { "1": "C1 C 4248" }, "Substitutions": {}, "AlternateLocationCount": 0, "DuplicateNames": [], "NonBoundarySubstitutionAndForeignAtoms": [], "UnmatchedModelNames": [ "O1" ], "ModelRmsd": 0.624 }, { "ModelName": "MAN", "Id": "2h6o_20_4273", "State": "Validated", "Flags": [ "Analyzed", 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"MissingRings": "", "WrongBonds": [], "NameMismatches": {}, "NameMismatchFlags": {}, "ForeignAtoms": { "7": "O6 O 4092, MAN 3 Z" }, "ChiralityMismatches": {}, "Substitutions": {}, "AlternateLocationCount": 0, "DuplicateNames": [], "NonBoundarySubstitutionAndForeignAtoms": [], "UnmatchedModelNames": [ "O1" ], "ModelRmsd": 0.599 } ], "Warnings": {}, "Errors": {} }, { "ModelName": "BMA", "LongName": "beta-d-mannopyranose", "Formula": "C{6}H{12}O{6}", "CoordinateSource": "CifModel", "ModelNames": { "1": "C1", "2": "C2", "3": "C3", "4": "C4", "5": "C5", "6": "C6", "7": "O1", "8": "O2", "9": "O3", "10": "O4", "11": "O5", "12": "O6" }, "ModelAtomTypes": { "1": "C", "2": "C", "3": "C", "4": "C", "5": "C", "6": "C", "7": "O", "8": "O", "9": "O", "10": "O", "11": "O", "12": "O" }, "PlanarAtoms": [], "ChiralAtoms": [ 1, 2, 3, 4, 5 ], "ChiralAtomsInfo": { "Planar": [], "Carbon": [ 1, 2, 3, 4, 5 ], "Metal": [], "NonSingleBond": [] }, "AtomNamingEquivalence": { "Charge": { "H61": "H61", "H62": 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"Residues": [ "NAG 2 J", "BMA 3 J" ], "MissingAtomCount": 0, "MissingRingCount": 0, "WrongBondCount": 0, "HasBondDiscrepancy": false, "NameMismatchCount": 0, "ForeignAtomCount": 1, "ChiralityMismatchCount": 0, "SubstitutionCount": 0, "UnmatchedMotiveAtomCount": 7, "MissingAtoms": [], "MissingRings": "", "WrongBonds": [], "NameMismatches": {}, "NameMismatchFlags": {}, "ForeignAtoms": { "7": "O4 O 3586, NAG 2 J" }, "ChiralityMismatches": {}, "Substitutions": {}, "AlternateLocationCount": 0, "DuplicateNames": [], "NonBoundarySubstitutionAndForeignAtoms": [], "UnmatchedModelNames": [ "O1" ], "ModelRmsd": 0.969 }, { "ModelName": "BMA", "Id": "2h6o_90_3982", "State": "Validated", "Flags": [ "Analyzed", "HasAll", "HasAll_Foreign", "HasAll_GoodChirality", "HasAll_GoodChirality_IgnorePlanarAndNonSingleBondErrors" ], "MainResidue": "BMA 9 U", "ResidueCount": 2, "Residues": [ "MAN 3 U", "BMA 9 U" ], "MissingAtomCount": 0, "MissingRingCount": 0, "WrongBondCount": 0, "HasBondDiscrepancy": false, "NameMismatchCount": 0, "ForeignAtomCount": 1, "ChiralityMismatchCount": 0, "SubstitutionCount": 0, "UnmatchedMotiveAtomCount": 7, "MissingAtoms": [], "MissingRings": "", "WrongBonds": [], "NameMismatches": {}, "NameMismatchFlags": {}, "ForeignAtoms": { "7": "O6 O 3926, MAN 3 U" }, "ChiralityMismatches": {}, "Substitutions": {}, "AlternateLocationCount": 0, "DuplicateNames": [], "NonBoundarySubstitutionAndForeignAtoms": [], "UnmatchedModelNames": [ "O1" ], "ModelRmsd": 1.025 } ], "Warnings": {}, "Errors": {} }, { "ModelName": "NDG", "LongName": "2-acetamido-2-deoxy-alpha-d-glucopyranose", "Formula": "C{8}H{15}N{1}O{6}", "CoordinateSource": "CifModel", "ModelNames": { "1": "C1", "2": "C2", "3": "C3", "4": "C4", "5": "C5", "6": "C6", "7": "C7", "8": "C8", "9": "O5", "10": "O3", "11": "O4", "12": "O6", "13": "O7", "14": "N2", "15": "O1" }, "ModelAtomTypes": { "1": "C", "2": "C", "3": "C", "4": "C", "5": "C", "6": "C", "7": "C", "8": "C", "9": "O", "10": "O", "11": "O", "12": "O", "13": "O", "14": "N", "15": "O" }, "PlanarAtoms": [], "ChiralAtoms": [ 1, 2, 3, 4, 5 ], "ChiralAtomsInfo": { "Planar": [], "Carbon": [ 1, 2, 3, 4, 5 ], "Metal": [], "NonSingleBond": [] }, "AtomNamingEquivalence": { "Charge": { "H81": "H81", "H82": "H81", "H83": "H81", "H61": "H61", "H62": "H61", "HO3": "HO3", "HO4": "HO3" }, "ChargeIgnoreBondTypes": { "O4": "O4", "O6": "O4" } }, "ModelBonds": { "1-2": 1, "1-9": 1, "1-15": 1, "2-3": 1, "2-14": 1, "3-4": 1, "3-10": 1, "4-5": 1, "4-11": 1, "5-6": 1, "5-9": 1, "6-12": 1, "7-8": 1, "7-13": 2, "7-14": 1 }, "Summary": { "Analyzed": 3, "HasAll": 3, "HasAll_BadChirality": 0, "HasAll_BadChirality_Carbon": 0, "HasAll_BadChirality_Metal": 0, "HasAll_BadChirality_NonSingleBond": 0, "HasAll_BadChirality_Other": 0, "HasAll_BadChirality_Planar": 0, "HasAll_Foreign": 3, "HasAll_GoodChirality": 3, "HasAll_GoodChirality_IgnorePlanarAndNonSingleBondErrors": 3, "HasAll_NameMismatch": 0, "HasAll_NameMismatch_ChargeEquiv": 0, "HasAll_NameMismatch_ChargeEquivIgnoreBondType": 0, "HasAll_NameMismatch_NonChargeEquiv": 0, "HasAll_NameMismatch_NonChargeEquivIgnoreBondType": 0, "HasAll_Substitutions": 1, "HasAll_WrongBonds": 0, "HasAll_ZeroRmsd": 0, "Has_AlternateLocation": 0, "Has_NamingIssue_Duplicates": 0, "Has_NamingIssue_NonBoundarySubstitutionOrForeign": 0, "Has_NamingIssue_NonIsomorphic": 0, "Missing": 0, "Missing_Atoms": 0, "Missing_Degenerate": 0, "Missing_Rings": 0, "NotAnalyzed": 0 }, "StructureNames": [ "2h6o" ], "NotAnalyzedNames": [], "Entries": [ { "ModelName": "NDG", "Id": "2h6o_16_4223", "State": "Validated", "Flags": [ "Analyzed", "HasAll", "HasAll_Foreign", "HasAll_GoodChirality", "HasAll_GoodChirality_IgnorePlanarAndNonSingleBondErrors" ], "MainResidue": "NDG 2 d", "ResidueCount": 2, "Residues": [ "NAG 1 d", "NDG 2 d" ], "MissingAtomCount": 0, "MissingRingCount": 0, "WrongBondCount": 0, "HasBondDiscrepancy": false, "NameMismatchCount": 0, "ForeignAtomCount": 1, "ChiralityMismatchCount": 0, "SubstitutionCount": 0, "UnmatchedMotiveAtomCount": 4, "MissingAtoms": [], "MissingRings": "", "WrongBonds": [], "NameMismatches": {}, "NameMismatchFlags": {}, "ForeignAtoms": { "15": "O4 O 4219, NAG 1 d" }, "ChiralityMismatches": {}, "Substitutions": {}, "AlternateLocationCount": 0, "DuplicateNames": [], "NonBoundarySubstitutionAndForeignAtoms": [], "UnmatchedModelNames": [ "O1" ], "ModelRmsd": 1.267 }, { "ModelName": "NDG", "Id": "2h6o_32_4330", "State": "Validated", "Flags": [ "Analyzed", "HasAll", "HasAll_Foreign", "HasAll_GoodChirality", "HasAll_GoodChirality_IgnorePlanarAndNonSingleBondErrors" ], "MainResidue": "NDG 2 f", "ResidueCount": 2, "Residues": [ "NAG 1 f", "NDG 2 f" ], "MissingAtomCount": 0, "MissingRingCount": 0, "WrongBondCount": 0, "HasBondDiscrepancy": false, "NameMismatchCount": 0, "ForeignAtomCount": 1, "ChiralityMismatchCount": 0, "SubstitutionCount": 0, "UnmatchedMotiveAtomCount": 4, "MissingAtoms": [], "MissingRings": "", "WrongBonds": [], "NameMismatches": {}, "NameMismatchFlags": {}, "ForeignAtoms": { "15": "O4 O 4326, NAG 1 f" }, "ChiralityMismatches": {}, "Substitutions": {}, "AlternateLocationCount": 0, "DuplicateNames": [], "NonBoundarySubstitutionAndForeignAtoms": [], "UnmatchedModelNames": [ "O1" ], "ModelRmsd": 1.033 }, { "ModelName": "NDG", "Id": "2h6o_41_3468", "State": "Validated", "Flags": [ "Analyzed", "HasAll", "HasAll_Foreign", "HasAll_GoodChirality", "HasAll_GoodChirality_IgnorePlanarAndNonSingleBondErrors", "HasAll_Substitutions" ], "MainResidue": "NDG 1 F", "ResidueCount": 2, "Residues": [ "ASN 114 A", "NDG 1 F" ], "MissingAtomCount": 0, "MissingRingCount": 0, "WrongBondCount": 0, "HasBondDiscrepancy": false, "NameMismatchCount": 0, "ForeignAtomCount": 1, "ChiralityMismatchCount": 0, "SubstitutionCount": 1, "UnmatchedMotiveAtomCount": 4, "MissingAtoms": [], "MissingRings": "", "WrongBonds": [], "NameMismatches": {}, "NameMismatchFlags": {}, "ForeignAtoms": { "15": "ND2 N 849, ASN 114 A" }, "ChiralityMismatches": {}, "Substitutions": { "15": "ND2 N 849" }, "AlternateLocationCount": 0, "DuplicateNames": [], "NonBoundarySubstitutionAndForeignAtoms": [], "UnmatchedModelNames": [ "O1" ], "ModelRmsd": 1.07 } ], "Warnings": {}, "Errors": {} }, { "ModelName": "FUC", "LongName": "alpha-l-fucopyranose", "Formula": "C{6}H{12}O{5}", "CoordinateSource": "CifModel", "ModelNames": { "1": "C1", "2": "C2", "3": "C3", "4": "C4", "5": "C5", "6": "C6", "7": "O1", "8": "O2", "9": "O3", "10": "O4", "11": "O5" }, "ModelAtomTypes": { "1": "C", "2": "C", "3": "C", "4": "C", "5": "C", "6": "C", "7": "O", "8": "O", "9": "O", "10": "O", "11": "O" }, "PlanarAtoms": [], "ChiralAtoms": [ 1, 2, 3, 4, 5 ], "ChiralAtomsInfo": { "Planar": [], "Carbon": [ 1, 2, 3, 4, 5 ], "Metal": [], "NonSingleBond": [] }, "AtomNamingEquivalence": { "Charge": { "H61": "H61", "H62": "H61", "H63": "H61", "HO3": "HO3", "HO4": "HO3" }, "ChargeIgnoreBondTypes": { "": "" } }, "ModelBonds": { "1-2": 1, "1-7": 1, "1-11": 1, "2-3": 1, "2-8": 1, "3-4": 1, "3-9": 1, "4-5": 1, "4-10": 1, "5-6": 1, "5-11": 1 }, "Summary": { "Analyzed": 2, "HasAll": 2, "HasAll_BadChirality": 1, "HasAll_BadChirality_Carbon": 1, "HasAll_BadChirality_Metal": 0, "HasAll_BadChirality_NonSingleBond": 0, "HasAll_BadChirality_Other": 0, "HasAll_BadChirality_Planar": 0, "HasAll_Foreign": 2, "HasAll_GoodChirality": 1, "HasAll_GoodChirality_IgnorePlanarAndNonSingleBondErrors": 1, "HasAll_NameMismatch": 0, "HasAll_NameMismatch_ChargeEquiv": 0, "HasAll_NameMismatch_ChargeEquivIgnoreBondType": 0, "HasAll_NameMismatch_NonChargeEquiv": 0, "HasAll_NameMismatch_NonChargeEquivIgnoreBondType": 0, "HasAll_Substitutions": 0, "HasAll_WrongBonds": 0, "HasAll_ZeroRmsd": 0, "Has_AlternateLocation": 0, "Has_NamingIssue_Duplicates": 0, "Has_NamingIssue_NonBoundarySubstitutionOrForeign": 0, "Has_NamingIssue_NonIsomorphic": 0, "Missing": 0, "Missing_Atoms": 0, "Missing_Degenerate": 0, "Missing_Rings": 0, "NotAnalyzed": 0 }, "StructureNames": [ "2h6o" ], "NotAnalyzedNames": [], "Entries": [ { "ModelName": "FUC", "Id": "2h6o_23_4306", "State": "Validated", "Flags": [ "Analyzed", "HasAll", "HasAll_BadChirality", "HasAll_BadChirality_Carbon", "HasAll_Foreign" ], "MainResidue": "FUC 9 d", "ResidueCount": 2, "Residues": [ "NAG 1 d", "FUC 9 d" ], "MissingAtomCount": 0, "MissingRingCount": 0, "WrongBondCount": 0, "HasBondDiscrepancy": false, "NameMismatchCount": 0, "ForeignAtomCount": 1, "ChiralityMismatchCount": 1, "SubstitutionCount": 0, "UnmatchedMotiveAtomCount": 1, "MissingAtoms": [], "MissingRings": "", "WrongBonds": [], "NameMismatches": {}, "NameMismatchFlags": {}, "ForeignAtoms": { "7": "O6 O 4221, NAG 1 d" }, "ChiralityMismatches": { "1": "C1 C 4306" }, "Substitutions": {}, "AlternateLocationCount": 0, "DuplicateNames": [], "NonBoundarySubstitutionAndForeignAtoms": [], "UnmatchedModelNames": [ "O1" ], "ModelRmsd": 0.486 }, { "ModelName": "FUC", "Id": "2h6o_40_4424", "State": "Validated", "Flags": [ "Analyzed", "HasAll", "HasAll_Foreign", "HasAll_GoodChirality", "HasAll_GoodChirality_IgnorePlanarAndNonSingleBondErrors" ], "MainResidue": "FUC 10 f", "ResidueCount": 2, "Residues": [ "NAG 1 f", "FUC 10 f" ], "MissingAtomCount": 0, "MissingRingCount": 0, "WrongBondCount": 0, "HasBondDiscrepancy": false, "NameMismatchCount": 0, "ForeignAtomCount": 1, "ChiralityMismatchCount": 0, "SubstitutionCount": 0, "UnmatchedMotiveAtomCount": 1, "MissingAtoms": [], "MissingRings": "", "WrongBonds": [], "NameMismatches": {}, "NameMismatchFlags": {}, "ForeignAtoms": { "7": "O6 O 4328, NAG 1 f" }, "ChiralityMismatches": {}, "Substitutions": {}, "AlternateLocationCount": 0, "DuplicateNames": [], "NonBoundarySubstitutionAndForeignAtoms": [], "UnmatchedModelNames": [ "O1" ], "ModelRmsd": 0.417 } ], "Warnings": {}, "Errors": {} }, { "ModelName": "GAL", "LongName": "beta-d-galactopyranose", "Formula": "C{6}H{12}O{6}", "CoordinateSource": "CifModel", "ModelNames": { "1": "C1", "2": "C2", "3": "C3", "4": "C4", "5": "C5", "6": "C6", "7": "O1", "8": "O2", "9": "O3", "10": "O4", "11": "O5", "12": "O6" }, "ModelAtomTypes": { "1": "C", "2": "C", "3": "C", "4": "C", "5": "C", "6": "C", "7": "O", "8": "O", "9": "O", "10": "O", "11": "O", "12": "O" }, "PlanarAtoms": [], "ChiralAtoms": [ 1, 2, 3, 4, 5 ], "ChiralAtomsInfo": { "Planar": [], "Carbon": [ 1, 2, 3, 4, 5 ], "Metal": [], "NonSingleBond": [] }, "AtomNamingEquivalence": { "Charge": { "H61": "H61", "H62": "H61", "H4": "H4", "H5": "H4", "HO3": "HO3", "HO4": "HO3" }, "ChargeIgnoreBondTypes": { "O4": "O4", "O6": "O4" } }, "ModelBonds": { "1-2": 1, "1-7": 1, "1-11": 1, "2-3": 1, "2-8": 1, "3-4": 1, "3-9": 1, "4-5": 1, "4-10": 1, "5-6": 1, "5-11": 1, "6-12": 1 }, "Summary": { "Analyzed": 6, "HasAll": 6, "HasAll_BadChirality": 0, "HasAll_BadChirality_Carbon": 0, "HasAll_BadChirality_Metal": 0, "HasAll_BadChirality_NonSingleBond": 0, "HasAll_BadChirality_Other": 0, "HasAll_BadChirality_Planar": 0, "HasAll_Foreign": 6, "HasAll_GoodChirality": 6, "HasAll_GoodChirality_IgnorePlanarAndNonSingleBondErrors": 6, "HasAll_NameMismatch": 0, "HasAll_NameMismatch_ChargeEquiv": 0, "HasAll_NameMismatch_ChargeEquivIgnoreBondType": 0, "HasAll_NameMismatch_NonChargeEquiv": 0, "HasAll_NameMismatch_NonChargeEquivIgnoreBondType": 0, "HasAll_Substitutions": 0, "HasAll_WrongBonds": 0, "HasAll_ZeroRmsd": 0, "Has_AlternateLocation": 0, "Has_NamingIssue_Duplicates": 0, "Has_NamingIssue_NonBoundarySubstitutionOrForeign": 0, "Has_NamingIssue_NonIsomorphic": 0, "Missing": 0, "Missing_Atoms": 0, "Missing_Degenerate": 0, "Missing_Rings": 0, "NotAnalyzed": 0 }, "StructureNames": [ "2h6o" ], "NotAnalyzedNames": [], "Entries": [ { "ModelName": "GAL", "Id": "2h6o_69_3739", "State": "Validated", "Flags": [ "Analyzed", "HasAll", "HasAll_Foreign", "HasAll_GoodChirality", "HasAll_GoodChirality_IgnorePlanarAndNonSingleBondErrors" ], "MainResidue": "GAL 7 M", "ResidueCount": 2, "Residues": [ "MAN 6 M", "GAL 7 M" ], "MissingAtomCount": 0, "MissingRingCount": 0, "WrongBondCount": 0, "HasBondDiscrepancy": false, "NameMismatchCount": 0, "ForeignAtomCount": 1, "ChiralityMismatchCount": 0, "SubstitutionCount": 0, "UnmatchedMotiveAtomCount": 4, "MissingAtoms": [], "MissingRings": "", "WrongBonds": [], "NameMismatches": {}, "NameMismatchFlags": {}, "ForeignAtoms": { "7": "O3 O 3735, MAN 6 M" }, "ChiralityMismatches": {}, "Substitutions": {}, "AlternateLocationCount": 0, "DuplicateNames": [], "NonBoundarySubstitutionAndForeignAtoms": [], "UnmatchedModelNames": [ "O1" ], "ModelRmsd": 0.418 }, { "ModelName": "GAL", "Id": "2h6o_70_3750", "State": "Validated", "Flags": [ "Analyzed", "HasAll", "HasAll_Foreign", "HasAll_GoodChirality", "HasAll_GoodChirality_IgnorePlanarAndNonSingleBondErrors" ], "MainResidue": "GAL 8 M", "ResidueCount": 2, "Residues": [ "GAL 7 M", "GAL 8 M" ], "MissingAtomCount": 0, "MissingRingCount": 0, "WrongBondCount": 0, "HasBondDiscrepancy": false, "NameMismatchCount": 0, "ForeignAtomCount": 1, "ChiralityMismatchCount": 0, "SubstitutionCount": 0, "UnmatchedMotiveAtomCount": 1, "MissingAtoms": [], "MissingRings": "", "WrongBonds": [], "NameMismatches": {}, "NameMismatchFlags": {}, "ForeignAtoms": { "7": "O3 O 3746, GAL 7 M" }, "ChiralityMismatches": {}, "Substitutions": {}, "AlternateLocationCount": 0, "DuplicateNames": [], "NonBoundarySubstitutionAndForeignAtoms": [], "UnmatchedModelNames": [ "O1" ], "ModelRmsd": 0.284 }, { "ModelName": "GAL", "Id": "2h6o_79_3855", "State": "Validated", "Flags": [ "Analyzed", "HasAll", "HasAll_Foreign", "HasAll_GoodChirality", "HasAll_GoodChirality_IgnorePlanarAndNonSingleBondErrors" ], "MainResidue": "GAL 7 Q", "ResidueCount": 2, "Residues": [ "MAN 6 Q", "GAL 7 Q" ], "MissingAtomCount": 0, "MissingRingCount": 0, "WrongBondCount": 0, "HasBondDiscrepancy": false, "NameMismatchCount": 0, "ForeignAtomCount": 1, "ChiralityMismatchCount": 0, "SubstitutionCount": 0, "UnmatchedMotiveAtomCount": 4, "MissingAtoms": [], "MissingRings": "", "WrongBonds": [], "NameMismatches": {}, "NameMismatchFlags": {}, "ForeignAtoms": { "7": "O3 O 3851, MAN 6 Q" }, "ChiralityMismatches": {}, "Substitutions": {}, "AlternateLocationCount": 0, "DuplicateNames": [], "NonBoundarySubstitutionAndForeignAtoms": [], "UnmatchedModelNames": [ "O1" ], "ModelRmsd": 0.345 }, { "ModelName": "GAL", "Id": "2h6o_80_3866", "State": "Validated", "Flags": [ "Analyzed", "HasAll", "HasAll_Foreign", "HasAll_GoodChirality", "HasAll_GoodChirality_IgnorePlanarAndNonSingleBondErrors" ], "MainResidue": "GAL 8 Q", "ResidueCount": 2, "Residues": [ "GAL 7 Q", "GAL 8 Q" ], "MissingAtomCount": 0, "MissingRingCount": 0, "WrongBondCount": 0, "HasBondDiscrepancy": false, "NameMismatchCount": 0, "ForeignAtomCount": 1, "ChiralityMismatchCount": 0, "SubstitutionCount": 0, "UnmatchedMotiveAtomCount": 1, "MissingAtoms": [], "MissingRings": "", "WrongBonds": [], "NameMismatches": {}, "NameMismatchFlags": {}, "ForeignAtoms": { "7": "O3 O 3862, GAL 7 Q" }, "ChiralityMismatches": {}, "Substitutions": {}, "AlternateLocationCount": 0, "DuplicateNames": [], "NonBoundarySubstitutionAndForeignAtoms": [], "UnmatchedModelNames": [ "O1" ], "ModelRmsd": 0.285 }, { "ModelName": "GAL", "Id": "2h6o_88_3960", "State": "Validated", "Flags": [ "Analyzed", "HasAll", "HasAll_Foreign", "HasAll_GoodChirality", "HasAll_GoodChirality_IgnorePlanarAndNonSingleBondErrors" ], "MainResidue": "GAL 7 U", "ResidueCount": 2, "Residues": [ "MAN 6 U", "GAL 7 U" ], "MissingAtomCount": 0, "MissingRingCount": 0, "WrongBondCount": 0, "HasBondDiscrepancy": false, "NameMismatchCount": 0, "ForeignAtomCount": 1, "ChiralityMismatchCount": 0, "SubstitutionCount": 0, "UnmatchedMotiveAtomCount": 4, "MissingAtoms": [], "MissingRings": "", "WrongBonds": [], "NameMismatches": {}, "NameMismatchFlags": {}, "ForeignAtoms": { "7": "O3 O 3956, MAN 6 U" }, "ChiralityMismatches": {}, "Substitutions": {}, "AlternateLocationCount": 0, "DuplicateNames": [], "NonBoundarySubstitutionAndForeignAtoms": [], "UnmatchedModelNames": [ "O1" ], "ModelRmsd": 0.308 }, { "ModelName": "GAL", "Id": "2h6o_89_3971", "State": "Validated", "Flags": [ "Analyzed", "HasAll", "HasAll_Foreign", "HasAll_GoodChirality", "HasAll_GoodChirality_IgnorePlanarAndNonSingleBondErrors" ], "MainResidue": "GAL 8 U", "ResidueCount": 2, "Residues": [ "GAL 7 U", "GAL 8 U" ], "MissingAtomCount": 0, "MissingRingCount": 0, "WrongBondCount": 0, "HasBondDiscrepancy": false, "NameMismatchCount": 0, "ForeignAtomCount": 1, "ChiralityMismatchCount": 0, "SubstitutionCount": 0, "UnmatchedMotiveAtomCount": 1, "MissingAtoms": [], "MissingRings": "", "WrongBonds": [], "NameMismatches": {}, "NameMismatchFlags": {}, "ForeignAtoms": { "7": "O3 O 3967, GAL 7 U" }, "ChiralityMismatches": {}, "Substitutions": {}, "AlternateLocationCount": 0, "DuplicateNames": [], "NonBoundarySubstitutionAndForeignAtoms": [], "UnmatchedModelNames": [ "O1" ], "ModelRmsd": 0.441 } ], "Warnings": {}, "Errors": {} } ] }