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B4V

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
N34C30sing1.39Å1.39Å
C30N31doub1.30Å1.30ÅAromatic
C30C29sing1.47Å1.47ÅAromatic
N31O32sing1.42Å1.41ÅAromatic
C10C9doub1.38Å1.39ÅAromatic
C10C11sing1.40Å1.41ÅAromatic
C9C8sing1.38Å1.39ÅAromatic
O16C13doub1.22Å1.21Å
N26N25sing1.40Å1.41ÅAromatic
N26N27doub1.29Å1.28ÅAromatic
C13C11sing1.48Å1.47Å
C13N15sing1.35Å1.36Å
S19C17sing1.71Å1.70ÅAromatic
S19C1sing1.76Å1.75ÅAromatic
C11C12doub1.40Å1.40ÅAromatic
C29N25sing1.40Å1.42Å
C29N33doub1.30Å1.31ÅAromatic
O32N33sing1.42Å1.41ÅAromatic
N15C17sing1.39Å1.39Å
C17N18doub1.29Å1.30ÅAromatic
C1C6sing1.51Å1.51Å
C1C2doub1.35Å1.35ÅAromatic
C6N5sing1.47Å1.48Å
N25C24sing1.35Å1.37ÅAromatic
N27C20sing1.34Å1.34ÅAromatic
C8C7doub1.38Å1.40ÅAromatic
N18C2sing1.32Å1.32ÅAromatic
C2C3sing1.52Å1.53Å
C3C4sing1.53Å1.55Å
C4N5sing1.47Å1.49Å
C12C7sing1.38Å1.38ÅAromatic
C7C14sing1.51Å1.51Å
N5C35sing1.47Å1.48Å
C24C20doub1.37Å1.38ÅAromatic
C24C28sing1.51Å1.52Å
C20C21sing1.47Å1.48Å
N22C21sing1.35Å1.36Å
N22C14sing1.46Å1.47Å
C21O23doub1.22Å1.22Å
C3H1sing1.09Å1.10Å
C3H2sing1.09Å1.10Å
C4H3sing1.09Å1.10Å
C4H4sing1.09Å1.10Å
C6H5sing1.09Å1.10Å
C6H6sing1.09Å1.10Å
C8H7sing1.08Å1.08Å
C9H8sing1.08Å1.08Å
C10H9sing1.08Å1.08Å
C12H10sing1.08Å1.08Å
C14H11sing1.09Å1.10Å
C14H12sing1.09Å1.10Å
N22H13sing0.97Å1.00Å
N15H15sing0.97Å1.00Å
C28H16sing1.09Å1.10Å
C28H17sing1.09Å1.10Å
C28H18sing1.09Å1.10Å
N34H19sing0.97Å1.00Å
N34H20sing0.97Å1.00Å
C35H21sing1.09Å1.10Å
C35H22sing1.09Å1.10Å
C35H23sing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
N34C30N31124.1°125.8°
N34C30C29127.4°125.9°
C30N34H19109.5°120.0°
C30N34H20109.5°120.0°
N31C30C29108.4°108.3°
C30N31O32108.2°107.8°
C30C29N25126.1°125.8°
C30C29N33107.5°108.4°
N31O32N33107.3°107.6°
C9C10C11119.3°119.9°
C10C9C8119.7°120.1°
C10C9H8120.2°119.9°
C9C10H9120.3°120.1°
C10C11C13122.2°120.1°
C10C11C12120.2°119.7°
C11C10H9120.4°120.1°
C9C8C7121.1°120.3°
C9C8H7119.5°119.8°
C8C9H8120.2°120.0°
O16C13C11119.1°120.0°
O16C13N15123.0°120.0°
N25N26N27109.2°108.4°
N26N25C29124.0°126.7°
N26N25C24106.2°106.7°
N26N27C20109.8°109.6°
C11C13N15117.9°120.0°
C13C11C12117.5°120.2°
C13N15C17126.5°120.0°
C13N15H15116.7°120.0°
C17S19C190.5°90.3°
S19C17N15125.4°124.9°
S19C17N18109.9°110.1°
S19C1C6126.1°126.7°
S19C1C2109.2°108.7°
C11C12C7120.0°119.8°
C11C12H10120.0°120.1°
N25C29N33126.2°125.8°
C29N25C24129.7°126.6°
C29N33O32108.6°107.9°
N15C17N18124.5°125.0°
C17N15H15116.8°119.9°
C17N18C2117.8°117.6°
C6C1C2124.7°124.6°
C1C6N5110.9°108.4°
C1C6H5109.1°109.7°
C1C6H6109.1°109.6°
C1C2N18112.5°113.3°
C1C2C3122.5°121.7°
C6N5C4115.7°111.0°
C6N5C35110.3°111.0°
N5C6H5109.1°109.6°
N5C6H6109.1°109.6°
N25C24C20106.3°106.8°
N25C24C28127.1°126.6°
N27C20C24108.5°108.4°
N27C20C21122.2°125.8°
C8C7C12119.5°120.2°
C8C7C14122.3°119.9°
C7C8H7119.4°119.9°
N18C2C3125.0°125.0°
C2C3C4112.4°108.2°
C2C3H1108.7°109.7°
C2C3H2108.7°109.7°
C3C4N5117.3°109.6°
C4C3H1108.7°109.7°
C4C3H2108.7°109.8°
C3C4H3107.5°109.4°
C3C4H4107.5°109.4°
C4N5C35113.0°111.0°
N5C4H3107.5°109.5°
N5C4H4107.5°109.5°
C12C7C14118.1°119.9°
C7C12H10120.0°120.1°
C7C14N22111.8°109.4°
C7C14H11108.9°109.5°
C7C14H12108.9°109.5°
N5C35H21109.5°109.5°
N5C35H22109.5°109.4°
N5C35H23109.5°109.5°
C20C24C28126.7°126.6°
C24C20C21129.3°125.8°
C24C28H16109.5°109.4°
C24C28H17109.5°109.5°
C24C28H18109.5°109.5°
C20C21N22117.3°120.0°
C20C21O23121.4°120.0°
C21N22C14123.1°120.0°
N22C21O23121.3°120.0°
C21N22H13118.5°120.0°
N22C14H11108.9°109.5°
N22C14H12108.9°109.4°
C14N22H13118.5°120.0°
H1C3H2109.5°109.7°
H3C4H4109.5°109.4°
H5C6H6109.5°109.8°
H11C14H12109.5°109.5°
H16C28H17109.5°109.5°
H16C28H18109.5°109.5°
H17C28H18109.4°109.5°
H19N34H20109.5°120.0°
H21C35H22109.5°109.5°
H21C35H23109.5°109.5°
H22C35H23109.4°109.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
N34C30N31C29178.2°180.0°
N34C30N31O32179.5°180.0°
N34C30C29N254.1°0.0°
N34C30C29N33179.4°179.7°
C30N34H19H20120.0°179.9°
N31C30C29N25177.7°180.0°
N31C30C29N332.5°0.2°
C30N31O32N330.2°0.3°
N31C30N34H190.0°0.1°
N31C30N34H20120.0°180.0°
C29C30N31O321.3°0.0°
C30C29N25N269.7°0.2°
C30C29N25N33174.4°179.7°
C30C29N33O322.5°0.4°
C30C29N25C24173.0°179.7°
C29C30N34H19177.9°179.9°
C29C30N34H2057.9°0.0°
N31O32N33C291.8°0.4°
C9C10C11H9180.0°179.9°
C10C9C8H8180.0°179.9°
C9C10C11C13177.0°180.0°
C9C10C11C121.5°0.3°
C10C9C8C71.6°0.0°
C10C9C8H7178.4°180.0°
C11C10C9C81.0°0.0°
C10C11C13O1627.6°180.0°
C10C11C13C12175.6°179.7°
C10C11C13N15154.6°0.0°
C10C11C12C72.7°0.6°
C11C10C9H8179.0°179.9°
C10C11C12H10177.3°180.0°
C9C8C7H7180.0°180.0°
C9C8C7C122.7°0.3°
C9C8C7C14179.3°180.0°
C8C9C10H9179.0°179.9°
O16C13C11N15177.9°180.0°
O16C13C11C12148.0°0.3°
O16C13N15C172.4°0.0°
O16C13N15H15177.6°180.0°
N26N25C29C24177.4°179.9°
N26N25C29N33164.7°179.9°
N25N26N27C200.9°0.4°
N26N25C24C200.4°0.0°
N26N25C24C28179.9°180.0°
N27N26N25C29178.7°179.8°
N27N26N25C240.8°0.3°
N26N27C20C240.7°0.4°
N26N27C20C21179.1°179.9°
C11C13N15C17175.4°180.0°
C13C11C12C7178.4°179.7°
C13C11C10H93.0°0.1°
C13C11C12H101.6°0.2°
C11C13N15H154.6°0.0°
C13N15C17S192.6°0.4°
N15C13C11C1229.8°179.7°
C13N15C17H15180.0°180.0°
C13N15C17N18176.0°180.0°
S19C17N15N18173.4°179.6°
C17S19C1C6179.6°180.0°
C17S19C1C20.7°0.3°
S19C17N18C22.5°0.3°
S19C17N15H15177.4°179.6°
C1S19C17N15176.0°180.0°
C1S19C17N181.7°0.3°
S19C1C6C2179.6°179.7°
S19C1C6N5156.9°163.7°
S19C1C2N180.4°0.2°
S19C1C2C3179.3°179.8°
S19C1C6H582.9°44.0°
S19C1C6H636.7°76.6°
C11C12C7C83.3°0.6°
C11C12C7H10180.0°179.5°
C11C12C7C14180.0°179.7°
C12C11C10H9178.5°179.8°
N25C29N33O32177.8°179.8°
C29N25C24C20178.1°180.0°
C29N25C24C282.4°0.0°
N33C29N25C2412.7°0.0°
N15C17N18C2176.8°180.0°
C17N18C2C11.9°0.1°
C17N18C2C3179.2°179.9°
N18C17N15H154.0°0.0°
C1C6N5H5120.2°119.7°
C1C6N5H6120.2°119.7°
C6C1C2N18179.2°179.9°
C6C1C2C30.3°0.1°
C1C6N5C444.4°50.6°
C1C6N5C3585.4°174.5°
C1C6H5H6119.4°120.5°
C2C1C6N522.7°16.0°
C1C2N18C3178.8°180.0°
C1C2C3C40.7°16.8°
C1C2C3H1121.1°136.4°
C1C2C3H2119.7°102.9°
C2C1C6H597.5°135.7°
C2C1C6H6142.9°103.7°
C6N5C4C346.2°71.6°
C6N5C4C35128.5°124.0°
C6N5C4H3167.3°48.4°
C6N5C4H475.0°168.4°
N5C6H5H6119.3°120.5°
C6N5C35H21180.0°176.1°
C6N5C35H2260.0°56.1°
C6N5C35H2360.0°63.8°
N25C24C20N270.2°0.2°
N25C24C20C28179.5°180.0°
N25C24C20C21178.4°180.0°
N25C24C28H1690.3°90.0°
N25C24C28H17149.7°30.0°
N25C24C28H1829.7°150.0°
N27C20C24C21178.2°179.8°
N27C20C24C28179.3°179.8°
N27C20C21N225.8°0.3°
N27C20C21O23174.7°179.7°
C8C7C12C14176.7°179.7°
C8C7C14N2251.6°90.0°
C7C8C9H8178.4°179.9°
C8C7C12H10176.7°179.9°
C8C7C14H11171.9°149.9°
C8C7C14H1268.7°29.9°
N18C2C3C4178.0°163.2°
N18C2C3H157.6°43.5°
N18C2C3H261.6°77.1°
C2C3C4H1120.4°119.7°
C2C3C4H2120.4°119.7°
C2C3C4N521.7°50.5°
C2C3H1H2118.7°120.6°
C2C3C4H3142.9°69.6°
C2C3C4H499.4°170.5°
C3C4N5H3121.1°120.0°
C3C4N5H4121.1°120.0°
C3C4N5C3582.3°164.4°
C4C3H1H2118.6°120.7°
C3C4H3H4116.4°119.9°
N5C4C3H198.7°170.1°
N5C4C3H2142.2°69.2°
N5C4H3H4116.5°120.0°
C4N5C6H575.8°170.3°
C4N5C6H6164.6°69.0°
C4N5C35H2148.8°60.0°
C4N5C35H22168.8°180.0°
C4N5C35H2371.2°60.1°
C12C7C14N22131.8°90.3°
C12C7C8H7177.2°179.7°
C12C7C14H1111.5°29.7°
C12C7C14H12107.9°149.7°
C7C14N22C21102.2°180.0°
C7C14N22H11120.3°120.1°
C7C14N22H12120.3°119.9°
C14C7C8H70.7°0.1°
C14C7C12H100.0°0.3°
C7C14H11H12119.0°120.0°
C7C14N22H1377.9°0.1°
C35N5C4H338.8°75.5°
C35N5C4H4156.5°44.4°
C35N5C6H5154.4°65.8°
C35N5C6H634.8°54.9°
N5C35H21H22120.0°120.0°
N5C35H21H23120.0°120.0°
N5C35H22H23120.0°119.9°
C24C20C21N22172.2°180.0°
C24C20C21O237.2°0.0°
C20C24C28H1690.3°90.0°
C20C24C28H1729.7°150.0°
C20C24C28H18149.7°30.0°
C28C24C20C211.1°0.0°
C24C28H16H17120.0°120.0°
C24C28H16H18120.0°120.0°
C24C28H17H18120.0°120.0°
C20C21N22O23179.5°180.0°
C20C21N22C14179.7°180.0°
C20C21N22H130.3°0.1°
C21N22C14H13180.0°179.9°
C21N22C14H11137.5°59.9°
C21N22C14H1218.2°60.1°
C14N22C21O230.2°0.1°
N22C14H11H12118.9°120.0°
O23C21N22H13179.8°179.9°
H1C3C4H322.4°50.0°
H1C3C4H4140.2°69.8°
H2C3C4H396.7°170.7°
H2C3C4H421.0°50.8°
H7C8C9H81.6°0.0°
H8C9C10H91.0°0.0°
H11C14N22H1342.5°119.9°
H12C14N22H13161.8°120.1°
H16C28H17H18120.0°120.0°
H21C35H22H23120.0°120.0°

222415

PDB entries from 2024-07-10

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