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A1BW5

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C01C02sing1.53Å1.53Å
C02C03sing1.53Å1.53Å
C03C04sing1.53Å1.53Å
C04O05sing1.43Å1.40Å
O05C06sing1.36Å1.40Å
C06C11doub1.39Å1.39ÅAromatic
C06C07sing1.39Å1.39ÅAromatic
C11C10sing1.38Å1.39ÅAromatic
C07C08doub1.38Å1.38ÅAromatic
C10C12sing1.51Å1.53Å
C10C09doub1.39Å1.39ÅAromatic
O23C22doub1.22Å1.19Å
C08C09sing1.40Å1.39ÅAromatic
C09C13sing1.48Å1.39Å
C22C13sing1.46Å1.41Å
C22N21sing1.35Å1.33Å
C13C14doub1.37Å1.39Å
C25C24sing1.53Å1.53Å
C25C26sing1.53Å1.52Å
C24N21sing1.47Å1.45Å
N21C20sing1.37Å1.37Å
C14C15sing1.41Å1.42Å
N27C26sing1.47Å1.45Å
C20C15doub1.41Å1.36ÅAromatic
C20N19sing1.33Å1.37ÅAromatic
C15C16sing1.40Å1.43ÅAromatic
N19C18doub1.32Å1.32ÅAromatic
C16N17doub1.32Å1.33ÅAromatic
C18N17sing1.33Å1.33ÅAromatic
C18N28sing1.38Å1.45Å
C29N28sing1.46Å1.45Å
C14H141sing1.08Å1.08Å
C11H111sing1.08Å1.08Å
C12H121sing1.09Å1.10Å
C12H123sing1.09Å1.10Å
C12H122sing1.09Å1.10Å
C01H013sing1.09Å1.10Å
C01H011sing1.09Å1.10Å
C01H012sing1.09Å1.10Å
C02H021sing1.09Å1.10Å
C02H022sing1.09Å1.10Å
C03H031sing1.09Å1.10Å
C03H032sing1.09Å1.10Å
C04H042sing1.09Å1.10Å
C04H041sing1.09Å1.10Å
C07H071sing1.08Å1.08Å
C08H081sing1.08Å1.08Å
C16H161sing1.08Å1.08Å
C24H242sing1.09Å1.10Å
C24H241sing1.09Å1.10Å
C25H252sing1.09Å1.10Å
C25H251sing1.09Å1.10Å
C26H261sing1.09Å1.10Å
C26H262sing1.09Å1.10Å
C29H293sing1.09Å1.10Å
C29H292sing1.09Å1.10Å
C29H291sing1.09Å1.10Å
N27H1sing1.01Å1.00Å
N27H271sing1.01Å1.00Å
N28H281sing0.97Å1.00Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C01C02C03113.2°109.5°
C02C01H013109.5°109.4°
C02C01H011109.5°109.4°
C02C01H012109.5°109.5°
C01C02H021108.6°109.5°
C01C02H022108.6°109.5°
C02C03C04110.5°109.5°
C03C02H021108.5°109.5°
C03C02H022108.5°109.5°
C02C03H031109.2°109.4°
C02C03H032109.2°109.5°
C03C04O05109.4°109.5°
C04C03H031109.2°109.4°
C04C03H032109.2°109.5°
C03C04H042109.5°109.4°
C03C04H041109.5°109.5°
C04O05C06111.8°117.0°
O05C04H042109.5°109.5°
O05C04H041109.5°109.5°
O05C06C11119.5°119.9°
O05C06C07120.1°120.0°
C11C06C07120.4°120.1°
C06C11C10119.6°120.1°
C06C11H111120.2°119.9°
C06C07C08119.8°120.1°
C06C07H071120.1°119.9°
C11C10C12119.0°120.0°
C11C10C09120.0°119.9°
C10C11H111120.2°120.0°
C07C08C09120.2°119.9°
C08C07H071120.1°119.9°
C07C08H081119.9°120.1°
C12C10C09121.0°120.0°
C10C12H121109.5°109.5°
C10C12H123109.5°109.5°
C10C12H122109.5°109.5°
C10C09C08120.0°119.9°
C10C09C13120.3°120.1°
O23C22C13120.4°119.9°
O23C22N21119.6°119.8°
C08C09C13119.7°120.0°
C09C08H081119.9°120.0°
C09C13C22121.2°120.3°
C09C13C14119.2°120.3°
C13C22N21120.0°120.3°
C22C13C14119.6°119.4°
C22N21C24119.0°119.7°
C22N21C20121.7°120.6°
C13C14C15118.7°119.0°
C13C14H141120.7°120.5°
C24C25C26112.2°109.5°
C25C24N21110.9°109.5°
C25C24H242109.1°109.5°
C25C24H241109.1°109.5°
C24C25H252108.8°109.5°
C24C25H251108.8°109.5°
C25C26N27109.7°109.5°
C26C25H252108.8°109.5°
C26C25H251108.8°109.5°
C25C26H261109.4°109.5°
C25C26H262109.4°109.5°
C24N21C20119.3°119.7°
N21C24H242109.1°109.4°
N21C24H241109.1°109.4°
N21C20C15120.5°120.4°
N21C20N19121.1°120.9°
C14C15C20119.5°120.2°
C14C15C16121.1°121.2°
C15C14H141120.7°120.6°
N27C26H261109.4°109.5°
N27C26H262109.4°109.4°
C26N27H1109.5°111.0°
C26N27H271109.4°111.0°
C15C20N19118.4°118.7°
C20C15C16119.3°118.6°
C20N19C18120.8°120.5°
C15C16N17118.3°118.6°
C15C16H161120.9°120.7°
N19C18N17122.3°122.4°
N19C18N28118.0°118.8°
C16N17C18120.9°121.2°
N17C16H161120.9°120.7°
N17C18N28119.7°118.8°
C18N28C29118.7°120.0°
C18N28H281107.1°120.0°
N28C29H293109.5°109.5°
N28C29H292109.5°109.5°
N28C29H291109.5°109.5°
C29N28H281107.1°120.0°
H121C12H123109.5°109.5°
H121C12H122109.4°109.5°
H123C12H122109.5°109.4°
H013C01H011109.4°109.5°
H013C01H012109.5°109.5°
H011C01H012109.4°109.5°
H021C02H022109.5°109.4°
H031C03H032109.5°109.5°
H042C04H041109.5°109.4°
H242C24H241109.5°109.5°
H252C25H251109.5°109.4°
H261C26H262109.5°109.5°
H293C29H292109.5°109.4°
H293C29H291109.5°109.5°
H292C29H291109.4°109.5°
H1N27H271109.5°111.0°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C01C02C03H021120.6°120.0°
C01C02C03H022120.6°120.0°
C01C02C03C0474.2°180.0°
C02C01H013H011120.0°119.9°
C02C01H013H012120.0°120.0°
C02C01H011H012120.0°120.0°
C01C02H021H022118.3°120.0°
C01C02C03H03145.9°60.0°
C01C02C03H032165.6°60.0°
C02C03C04H031120.1°119.9°
C02C03C04H032120.1°120.1°
C02C03C04O05150.4°180.0°
C03C02C01H013180.0°179.9°
C03C02C01H01160.0°60.0°
C03C02C01H01260.0°60.1°
C03C02H021H022118.3°120.0°
C02C03H031H032119.5°120.1°
C02C03C04H04230.4°60.0°
C02C03C04H04189.6°59.9°
C03C04O05H042120.0°120.0°
C03C04O05H041120.0°120.0°
C03C04O05C06169.9°180.0°
C04C03C02H021165.2°60.0°
C04C03C02H02246.4°60.0°
C04C03H031H032119.5°120.0°
C03C04H042H041120.0°120.0°
C04O05C06C11106.4°180.0°
C04O05C06C0773.2°0.0°
O05C04C03H03189.4°60.0°
O05C04C03H03230.3°60.0°
O05C04H042H041120.0°120.0°
O05C06C11C07179.6°179.9°
O05C06C11C10179.9°180.0°
O05C06C07C08179.8°180.0°
O05C06C11H1110.1°0.3°
C06O05C04H04270.1°60.0°
C06O05C04H04149.9°60.0°
O05C06C07H0710.2°0.1°
C06C11C10H111180.0°179.7°
C11C06C07C080.2°0.0°
C06C11C10C12179.8°179.7°
C06C11C10C090.5°0.3°
C11C06C07H071179.8°180.0°
C07C06C11C100.3°0.0°
C06C07C08H071180.0°179.9°
C06C07C08C090.3°0.2°
C07C06C11H111179.7°179.7°
C06C07C08H081179.7°179.9°
C11C10C12C09179.7°180.0°
C11C10C09C080.6°0.6°
C11C10C09C13179.8°180.0°
C11C10C12H12190.2°90.0°
C11C10C12H123149.8°150.0°
C11C10C12H12229.8°30.0°
C07C08C09C100.5°0.6°
C07C08C09H081180.0°179.7°
C07C08C09C13179.7°180.0°
C12C10C09C08179.7°179.4°
C12C10C09C130.5°0.0°
C12C10C11H1110.2°0.0°
C10C12H121H123120.0°120.0°
C10C12H121H122120.0°120.0°
C10C12H123H122120.0°120.0°
C10C09C08C13179.2°179.4°
C10C09C13C2293.9°105.0°
C10C09C13C1486.4°75.0°
C09C10C11H111179.5°180.0°
C09C10C12H12190.2°90.0°
C09C10C12H12329.9°30.0°
C09C10C12H122149.9°150.0°
C10C09C08H081179.5°179.7°
O23C22C13C090.2°0.0°
O23C22C13N21180.0°179.4°
O23C22C13C14179.9°179.9°
O23C22N21C240.1°0.6°
O23C22N21C20179.9°179.8°
C08C09C13C2286.9°74.4°
C08C09C13C1492.8°105.6°
C09C08C07H071179.7°179.7°
C09C13C22C14179.7°180.0°
C09C13C22N21179.8°179.5°
C09C13C14C15179.8°180.0°
C09C13C14H1410.2°0.3°
C13C09C08H0810.2°0.3°
C13C22N21C24179.9°180.0°
C13C22N21C200.1°0.8°
C22C13C14C150.1°0.0°
C22C13C14H141179.9°179.7°
N21C22C13C140.1°0.5°
C22N21C24C2572.1°90.0°
C22N21C24C20180.0°179.2°
C22N21C20C150.1°0.6°
C22N21C20N19179.9°179.5°
C22N21C24H242167.7°30.0°
C22N21C24H24148.1°150.0°
C13C14C15H141180.0°179.7°
C13C14C15C200.1°0.3°
C13C14C15C16180.0°179.8°
C24C25C26H252120.4°120.1°
C24C25C26H251120.4°120.0°
C25C24N21H242120.2°120.0°
C25C24N21H241120.2°120.0°
C25C24N21C20107.9°89.2°
C24C25C26N27172.6°180.0°
C25C24H242H241119.3°120.1°
C24C25H252H251118.8°120.0°
C24C25C26H26152.6°60.0°
C24C25C26H26267.3°60.1°
C26C25C24N2148.1°180.0°
C25C26N27H261120.0°120.0°
C25C26N27H262120.0°120.0°
C26C25C24H24272.1°60.1°
C26C25C24H241168.3°60.0°
C26C25H252H251118.8°120.0°
C25C26H261H262119.9°120.0°
C25C26N27H1180.0°56.1°
C25C26N27H27160.0°180.0°
C24N21C20C15179.9°179.7°
C24N21C20N190.0°0.3°
N21C24H242H241119.3°120.0°
N21C24C25H25272.3°60.0°
N21C24C25H251168.5°60.0°
N21C20C15C140.1°0.0°
N21C20C15N19179.9°179.9°
N21C20C15C16179.9°180.0°
N21C20N19C18180.0°180.0°
C20N21C24H24212.4°150.8°
C20N21C24H241131.9°30.8°
C14C15C20C16180.0°180.0°
C14C15C20N19180.0°179.9°
C14C15C16N17180.0°180.0°
C14C15C16H1610.0°0.1°
N27C26C25H25266.9°59.9°
N27C26C25H25152.3°60.0°
N27C26H261H262119.9°119.9°
C26N27H1H271120.0°123.9°
C15C20N19C180.1°0.1°
C20C15C16N170.1°0.0°
C20C15C14H141179.9°179.9°
C20C15C16H161179.9°179.9°
N19C20C15C160.0°0.0°
C20N19C18N170.2°0.1°
C20N19C18N28179.6°180.0°
C15C16N17H161180.0°179.9°
C15C16N17C180.2°0.0°
C16C15C14H1410.1°0.1°
N19C18N17C160.2°0.1°
N19C18N17N28179.4°179.9°
N19C18N28C2934.5°180.0°
N19C18N28H281155.8°0.0°
C16N17C18N28179.6°180.0°
N17C18N28C29145.0°0.1°
C18N17C16H161179.8°179.9°
N17C18N28H28123.7°180.0°
C18N28C29H281121.3°180.0°
C18N28C29H293180.0°59.9°
C18N28C29H29260.0°60.0°
C18N28C29H29160.0°180.0°
N28C29H293H292120.0°120.0°
N28C29H293H291120.0°120.0°
N28C29H292H291120.0°120.0°
H121C12H123H122120.0°120.0°
H013C01H011H012120.0°120.1°
H013C01C02H02159.4°59.9°
H013C01C02H02259.5°60.0°
H011C01C02H02160.5°60.0°
H011C01C02H022179.4°179.9°
H012C01C02H021179.5°179.9°
H012C01C02H02260.6°60.0°
H021C02C03H03174.6°180.0°
H021C02C03H03245.1°60.0°
H022C02C03H031166.5°60.0°
H022C02C03H03273.8°180.0°
H031C03C04H042150.6°179.9°
H031C03C04H04130.6°60.0°
H032C03C04H04289.7°60.1°
H032C03C04H041150.3°180.0°
H071C07C08H0810.3°0.0°
H242C24C25H252167.5°60.0°
H242C24C25H25148.3°179.9°
H241C24C25H25247.9°179.9°
H241C24C25H25171.3°60.0°
H252C25C26H261173.0°179.9°
H252C25C26H26253.1°60.0°
H251C25C26H26167.8°60.0°
H251C25C26H262172.3°180.0°
H261C26N27H160.0°63.9°
H261C26N27H271180.0°60.0°
H262C26N27H160.0°176.1°
H262C26N27H27160.1°60.0°
H293C29H292H291120.0°120.0°
H293C29N28H28158.7°120.0°
H292C29N28H281178.7°120.0°
H291C29N28H28161.3°0.0°

250835

PDB entries from 2026-03-18

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