{ "Version": "1.1.14.10.16", "Errors": {}, "ValidationType": "CustomModels", "MotiveCount": 299, "Models": [ { "ModelName": "CHD", "LongName": "cholic acid", "Formula": "C{24}H{40}O{5}", "CoordinateSource": "CifModel", "ModelNames": { "1": "C1", "2": "C2", "3": "C3", "4": "O3", "5": "C4", "6": "C5", "7": "C6", "8": "C7", "9": "O7", "10": "C8", "11": "C9", "12": "C10", "13": "C11", "14": "C12", "15": "O12", "16": "C13", "17": "C14", "18": "C15", "19": "C16", "20": "C17", "21": "C18", "22": "C19", "23": "C20", "24": "C21", "25": "C22", "26": "C23", "27": "O25", "28": "C24", "29": "O26" }, "PlanarAtoms": [], "ChiralAtoms": [ 3, 6, 8, 10, 11, 12, 14, 16, 17, 20, 23 ], "ChiralAtomsInfo": { "Planar": [], "Carbon": [ 3, 6, 8, 10, 11, 12, 14, 16, 17, 20, 23 ], "Metal": [], "NonSingleBond": [] }, "ModelBonds": { "1-2": 1, "1-12": 1, "2-3": 1, "3-4": 1, "3-5": 1, "5-6": 1, "6-7": 1, "6-12": 1, "7-8": 1, "8-9": 1, "8-10": 1, "10-11": 1, "10-17": 1, "11-12": 1, "11-13": 1, "12-22": 1, "13-14": 1, 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"AlternateLocationCount": 0, "ModelRmsd": 0.0 }, { "ModelName": "CHD", "Id": "1ON5_0_379", "State": "Validated", "Flags": [ "Analyzed", "HasAll", "HasAll_Foreign", "HasAll_GoodChirality", "HasAll_GoodChirality_IgnorePlanarAndNonSingleBondErrors", "HasAll_NameMismatch", "HasAll_Substitutions" ], "MainResidue": "CHD 1 A", "ResidueCount": 2, "Residues": [ "CHD 1 A", "5AT 2 A" ], "MissingAtomCount": 0, "MissingRingCount": 0, "WrongBondCount": 0, "HasBondDiscrepancy": false, "NameMismatchCount": 1, "ForeignAtomCount": 1, "ChiralityMismatchCount": 0, "SubstitutionCount": 1, "UnmatchedMotiveAtomCount": 1, "MissingAtoms": [], "MissingRings": "", "WrongBonds": [], "NameMismatches": { "29": "O25 O 405" }, "ForeignAtoms": { "27": "N5' N 1, 5AT 2 A" }, "ChiralityMismatches": {}, "Substitutions": { "27": "N5' N 1" }, "AlternateLocationCount": 0, "ModelRmsd": 0.611 }, { "ModelName": "CHD", "Id": "1ON5_1_446", "State": "Validated", "Flags": [ "Analyzed", "HasAll", "HasAll_Foreign", 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