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SummaryGeometryRelated PDB entries

A1ATH

Bonds
First atomSecond atomBond order typeDistance
(experimental model)		Distance
(ideal model)		Properties
O18C17doub1.22Å1.17Å
F14C13sing1.40Å1.35Å
C09C08doub1.38Å1.38ÅAromatic
C09C10sing1.38Å1.38ÅAromatic
C08C07sing1.38Å1.37ÅAromatic
F16C13sing1.40Å1.35Å
C17C19sing1.48Å1.50Å
C17N01sing1.35Å1.41Å
O24C23sing1.44Å1.41Å
O24C25sing1.44Å1.42Å
C20C19doub1.39Å1.37ÅAromatic
C20C21sing1.40Å1.40ÅAromatic
C19N32sing1.34Å1.32ÅAromatic
C13C10sing1.51Å1.52Å
C13F15sing1.40Å1.35Å
C23C22sing1.51Å1.51Å
C10C11doub1.38Å1.38ÅAromatic
C07C06sing1.51Å1.58Å
C07C12doub1.38Å1.39ÅAromatic
C06N01sing1.47Å1.44Å
C06C05sing1.53Å1.46Å
N32C31doub1.31Å1.30ÅAromatic
C21C22doub1.40Å1.44ÅAromatic
C21C30sing1.42Å1.34ÅAromatic
C22C26sing1.37Å1.30ÅAromatic
N01C02sing1.47Å1.48Å
C25C26sing1.51Å1.52Å
C31C30sing1.41Å1.40ÅAromatic
C30N29doub1.33Å1.34ÅAromatic
C26C27doub1.40Å1.42ÅAromatic
C11C12sing1.38Å1.38ÅAromatic
N29C27sing1.32Å1.30ÅAromatic
C05O04sing1.43Å1.42Å
C27N28sing1.39Å1.45Å
C02C03sing1.53Å1.52Å
O04C03sing1.43Å1.42Å
C02H1sing1.09Å1.10Å
C02H2sing1.09Å1.10Å
C03H3sing1.09Å1.10Å
C03H4sing1.09Å1.10Å
C05H5sing1.09Å1.10Å
C05H6sing1.09Å1.10Å
C06H7sing1.09Å1.10Å
C08H8sing1.08Å1.08Å
C09H9sing1.08Å1.08Å
C11H10sing1.08Å1.08Å
C12H11sing1.08Å1.08Å
C20H12sing1.08Å1.08Å
C23H13sing1.09Å1.10Å
C23H14sing1.09Å1.10Å
C25H15sing1.09Å1.10Å
C25H16sing1.09Å1.10Å
C31H17sing1.08Å1.08Å
N28H18sing0.97Å1.00Å
N28H19sing0.97Å1.00Å
Angles
First atomSecond atomThird atomAngle
(experimental model)		Angle
(ideal model)
O18C17C19121.5°120.0°
O18C17N01117.1°120.0°
F14C13F16108.3°109.4°
F14C13C10109.1°109.5°
F14C13F15109.5°109.4°
C08C09C10120.5°120.0°
C09C08C07120.4°120.0°
C09C08H8119.8°120.0°
C08C09H9119.8°120.0°
C09C10C13118.2°120.0°
C09C10C11119.6°120.0°
C10C09H9119.8°120.0°
C08C07C06118.5°120.0°
C08C07C12119.5°120.0°
C07C08H8119.8°119.9°
F16C13C10109.7°109.5°
F16C13F15109.1°109.5°
C19C17N01121.4°120.0°
C17C19C20124.5°119.4°
C17C19N32117.1°119.4°
C17N01C06121.3°121.0°
C17N01C02124.3°121.0°
C23O24C25106.7°104.6°
O24C23C22104.6°105.9°
O24C23H13110.7°110.2°
O24C23H14110.7°110.2°
O24C25C26104.2°105.9°
O24C25H15110.8°110.1°
O24C25H16110.8°110.2°
C19C20C21120.2°118.5°
C20C19N32118.4°121.3°
C19C20H12119.9°120.7°
C20C21C22124.3°122.3°
C20C21C30118.6°118.5°
C21C20H12119.9°120.8°
C19N32C31123.7°122.7°
C10C13F15111.1°109.5°
C13C10C11122.2°120.0°
C23C22C21130.7°133.8°
C23C22C26109.1°107.7°
C22C23H13110.7°110.2°
C22C23H14110.7°110.1°
C10C11C12119.9°120.0°
C10C11H10120.1°119.9°
C06C07C12122.0°120.0°
C07C06N01115.4°109.7°
C07C06C05110.7°109.7°
C07C06H7105.1°109.8°
C07C12C11120.1°120.0°
C07C12H11119.9°120.0°
N01C06C05111.8°108.4°
C06N01C02114.4°118.0°
N01C06H7106.7°109.7°
C06C05O04111.1°109.2°
C06C05H5109.1°109.5°
C06C05H6109.1°109.5°
C05C06H7106.4°109.7°
N32C31C30119.8°120.4°
N32C31H17120.1°119.8°
C22C21C30117.1°119.1°
C21C22C26120.2°118.5°
C21C30C31119.2°118.5°
C21C30N29121.9°119.9°
C22C26C25108.5°107.5°
C22C26C27119.4°119.7°
N01C02C03111.5°108.4°
N01C02H1109.0°109.7°
N01C02H2109.0°109.7°
C25C26C27132.2°132.8°
C26C25H15110.8°110.2°
C26C25H16110.8°110.2°
C31C30N29118.9°121.6°
C30C31H17120.1°119.8°
C30N29C27121.6°121.3°
C26C27N29119.9°121.5°
C26C27N28119.9°119.3°
C12C11H10120.0°120.0°
C11C12H11120.0°120.0°
N29C27N28120.2°119.2°
C05O04C03113.3°114.2°
O04C05H5109.1°109.6°
O04C05H6109.0°109.5°
C27N28H18109.5°120.0°
C27N28H19109.5°120.0°
C02C03O04109.1°109.2°
C03C02H1109.0°109.7°
C03C02H2109.0°109.7°
C02C03H3109.6°109.5°
C02C03H4109.5°109.5°
O04C03H3109.6°109.5°
O04C03H4109.6°109.6°
H1C02H2109.5°109.7°
H3C03H4109.5°109.5°
H5C05H6109.5°109.5°
H13C23H14109.5°110.1°
H15C25H16109.5°110.1°
H18N28H19109.5°120.0°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)		Torsion
(ideal model)
O18C17C19N01177.8°179.9°
O18C17C19C2086.6°21.1°
O18C17C19N3292.6°159.2°
O18C17N01C060.9°6.9°
O18C17N01C02178.3°173.1°
F14C13C10C0992.4°30.0°
F14C13F16C10119.0°120.0°
F14C13F16F15119.1°120.0°
F14C13C10F15120.8°120.0°
F14C13C10C1187.6°150.0°
C08C09C10H9180.0°179.9°
C09C08C07H8180.0°180.0°
C08C09C10C13180.0°179.9°
C08C09C10C110.0°0.1°
C09C08C07C06179.1°180.0°
C09C08C07C121.2°0.2°
C10C09C08C070.7°0.1°
C09C10C13F1626.1°150.0°
C09C10C13C11180.0°180.0°
C09C10C13F15146.8°90.0°
C09C10C11C120.2°0.2°
C10C09C08H8179.3°180.0°
C09C10C11H10179.8°180.0°
C08C07C06C12177.8°179.8°
C08C07C06N0159.9°60.6°
C08C07C06C05171.9°58.3°
C08C07C12C111.0°0.5°
C08C07C06H757.3°178.9°
C07C08C09H9179.3°180.0°
C08C07C12H11179.0°179.7°
F16C13C10F15120.7°120.1°
F16C13C10C11153.9°30.0°
C17C19C20N32179.1°179.6°
C17C19C20C21179.9°180.0°
C19C17N01C06177.0°173.2°
C17C19N32C31179.8°179.7°
C19C17N01C020.3°6.8°
C17C19C20H120.1°0.0°
N01C17C19C2095.6°158.8°
N01C17C19N3285.3°20.8°
C17N01C06C07103.3°9.8°
C17N01C06C02177.6°180.0°
C17N01C06C05129.0°129.5°
C17N01C02C03130.5°129.5°
C17N01C02H1109.2°110.8°
C17N01C02H210.2°9.7°
C17N01C06H713.0°110.8°
O24C23C22H13119.2°119.1°
O24C23C22H14119.2°119.1°
O24C23C22C21164.6°162.6°
O24C23C22C2615.8°17.5°
C23O24C25C2625.5°28.0°
O24C23H13H14122.3°121.8°
C23O24C25H1593.6°147.1°
C23O24C25H16144.7°91.2°
C25O24C23C2225.6°28.0°
O24C25C26C2215.8°17.6°
O24C25C26H15119.1°119.1°
O24C25C26H16119.2°119.2°
O24C25C26C27164.7°162.5°
C25O24C23H13144.8°91.2°
C25O24C23H1493.7°147.1°
O24C25H15H16122.5°121.8°
C19C20C21H12180.0°179.9°
C20C19N32C310.6°0.7°
C19C20C21C22179.7°180.0°
C19C20C21C300.8°0.1°
C21C20C19N320.8°0.4°
C20C21C22C230.9°0.0°
C20C21C22C30178.9°179.9°
C20C21C22C26179.5°179.9°
C20C21C30C310.6°0.0°
C20C21C30N29179.7°179.9°
C19N32C31C300.5°0.6°
N32C19C20H12179.2°179.7°
C19N32C31H17179.5°179.6°
C13C10C11C12179.7°179.8°
C13C10C09H90.0°0.0°
C13C10C11H100.3°0.0°
F15C13C10C1133.2°90.1°
C23C22C21C26179.6°179.9°
C23C22C21C30179.8°179.9°
C23C22C26C250.1°0.0°
C23C22C26C27179.7°180.0°
C22C23H13H14122.2°121.7°
C10C11C12C070.3°0.5°
C10C11C12H10180.0°179.8°
C11C10C09H9180.0°180.0°
C10C11C12H11179.7°179.7°
C07C06N01C05127.7°119.7°
C07C06N01H7116.3°120.6°
C07C06C05H7113.7°120.6°
C07C06N01C0279.1°170.2°
C06C07C12C11178.8°179.8°
C07C06C05O0476.1°172.0°
C07C06C05H5163.7°68.0°
C07C06C05H644.1°52.0°
C06C07C08H80.9°0.0°
C06C07C12H111.2°0.0°
C12C07C06N01122.3°119.6°
C12C07C06C056.0°121.4°
C07C12C11H11180.0°179.8°
C12C07C06H7120.5°0.9°
C12C07C08H8178.8°179.8°
C07C12C11H10179.7°179.8°
N01C06C05H7116.2°119.7°
N01C06C05O0454.1°52.2°
C06N01C02C0347.0°50.5°
C06N01C02H173.3°69.2°
C06N01C02H2167.3°170.3°
N01C06C05H566.2°172.3°
N01C06C05H6174.3°67.7°
C05C06N01C0248.6°50.5°
C06C05O04H5120.2°120.0°
C06C05O04H6120.2°119.9°
C06C05O04C0361.3°62.5°
C06C05H5H6119.3°120.1°
N32C31C30C210.5°0.3°
N32C31C30H17180.0°179.7°
N32C31C30N29179.8°179.8°
C21C22C26C25179.6°179.9°
C22C21C30C31179.6°180.0°
C22C21C30N290.7°0.1°
C21C22C26C270.0°0.1°
C22C21C20H120.3°0.1°
C21C22C23H1345.4°78.3°
C21C22C23H1476.2°43.4°
C30C21C22C260.6°0.2°
C21C30C31N29179.7°179.9°
C21C30N29C270.2°0.0°
C30C21C20H12179.2°180.0°
C21C30C31H17179.6°180.0°
C22C26C25C27179.6°180.0°
C22C26C27N290.5°0.0°
C22C26C27N28179.8°179.9°
C26C22C23H13135.0°101.6°
C26C22C23H14103.5°136.6°
C22C26C25H15103.4°136.7°
C22C26C25H16134.9°101.7°
N01C02C03H1120.3°119.7°
N01C02C03H2120.3°119.7°
N01C02C03O0450.2°52.3°
N01C02H1H2119.1°120.5°
N01C02C03H3170.1°67.6°
N01C02C03H469.8°172.3°
C02N01C06H7164.6°69.2°
C25C26C27N29180.0°180.0°
C25C26C27N280.6°0.1°
C26C25H15H16122.5°121.7°
C31C30N29C27179.9°179.9°
C30N29C27C260.4°0.1°
C30N29C27N28179.8°180.0°
N29C30C31H170.2°0.0°
C26C27N29N28179.4°179.9°
C27C26C25H1576.2°43.4°
C27C26C25H1645.5°78.3°
C26C27N28H18179.4°0.1°
C26C27N28H1960.6°180.0°
N29C27N28H180.0°180.0°
N29C27N28H19120.0°0.1°
C05O04C03C0258.5°62.6°
C05O04C03H3178.5°57.4°
C05O04C03H461.4°177.5°
O04C05H5H6119.2°120.1°
O04C05C06H7170.2°67.4°
C27N28H18H19120.0°179.9°
C02C03O04H3120.0°119.9°
C02C03O04H4119.9°120.0°
C03C02H1H2119.1°120.5°
C02C03H3H4120.1°120.1°
O04C03C02H170.1°67.4°
O04C03C02H2170.5°172.1°
O04C03H3H4120.2°120.2°
C03O04C05H559.0°177.5°
C03O04C05H6178.5°57.4°
H1C02C03H349.8°172.6°
H1C02C03H4169.9°52.6°
H2C02C03H369.6°52.1°
H2C02C03H450.5°67.9°
H5C05C06H749.9°52.6°
H6C05C06H769.6°172.6°
H8C08C09H90.7°0.1°
H10C11C12H110.3°0.0°

251422

PDB entries from 2026-04-01

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