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SummaryGeometryRelated PDB entries

QBI

Bonds
First atomSecond atomBond order typeDistance
(experimental model)		Distance
(ideal model)		Properties
C02N01sing1.37Å1.46Å
N03C02doub1.33Å1.30Å
C04N03sing1.33Å1.33Å
O05C04doub1.22Å1.18Å
N06C04sing1.34Å1.32Å
C07N06sing1.36Å1.32Å
C08C07doub1.37Å1.38Å
C09C08sing1.43Å1.52Å
C10C09trip1.17Å1.19Å
C11C10sing1.47Å1.52Å
N12C11sing1.47Å1.44Å
S13N12sing1.66Å1.69Å
O14S13doub1.42Å1.46Å
O15S13doub1.42Å1.45Å
C16S13sing1.81Å1.82Å
C17C16sing1.55Å1.58Å
C18C17sing1.55Å1.60Å
C19C18sing1.54Å1.36Å
C20C19sing1.54Å1.65Å
C02C08sing1.47Å1.36Å
C16C20sing1.54Å1.38Å
N12H121sing0.97Å1.00Å
C17H171sing1.09Å1.10Å
C17H172sing1.09Å1.10Å
C20H201sing1.09Å1.10Å
C20H202sing1.09Å1.10Å
C07H071sing1.08Å1.08Å
C11H112sing1.09Å1.10Å
C11H111sing1.09Å1.10Å
C16H161sing1.09Å1.10Å
C18H181sing1.09Å1.10Å
C18H182sing1.09Å1.10Å
C19H191sing1.09Å1.10Å
C19H192sing1.09Å1.10Å
N01H011sing0.97Å1.00Å
N01H012sing0.97Å1.00Å
N06H061sing0.97Å1.00Å
Angles
First atomSecond atomThird atomAngle
(experimental model)		Angle
(ideal model)
N01C02N03120.1°120.6°
N01C02C08119.1°120.5°
C02N01H011120.0°120.0°
C02N01H012120.0°120.0°
C02N03C04120.3°120.8°
N03C02C08120.8°118.9°
N03C04O05119.9°119.0°
N03C04N06120.4°122.0°
O05C04N06119.6°118.9°
C04N06C07121.6°121.1°
C04N06H061119.2°119.4°
N06C07C08118.1°119.1°
N06C07H071120.9°120.4°
C07N06H061119.2°119.5°
C07C08C09123.6°120.9°
C07C08C02118.7°118.1°
C08C07H071120.9°120.5°
C08C09C10174.1°180.0°
C09C08C02117.8°120.9°
C09C10C11171.3°179.9°
C10C11N12105.9°109.5°
C10C11H112110.4°109.5°
C10C11H111110.4°109.4°
C11N12S13119.7°120.0°
C11N12H121106.9°120.0°
N12C11H112110.3°109.5°
N12C11H111110.3°109.4°
N12S13O14107.2°104.2°
N12S13O15109.4°104.3°
N12S13C16109.4°104.4°
S13N12H121106.9°120.0°
O14S13O15107.2°121.1°
O14S13C16111.0°110.5°
O15S13C16112.5°110.6°
S13C16C17107.8°110.5°
S13C16C20109.5°110.5°
S13C16H161107.7°110.4°
C16C17C18104.7°102.8°
C17C16C20107.7°104.2°
C16C17H171110.7°110.7°
C16C17H172110.6°110.8°
C17C16H161110.4°110.5°
C17C18C19106.0°104.2°
C18C17H171110.6°110.7°
C18C17H172110.7°110.9°
C17C18H181110.3°110.5°
C17C18H182110.3°110.5°
C18C19C20106.3°106.6°
C19C18H181110.3°110.5°
C19C18H182110.3°110.6°
C18C19H191110.3°110.1°
C18C19H192110.3°110.0°
C19C20C16107.1°106.6°
C19C20H201110.1°110.0°
C19C20H202110.1°110.1°
C20C19H191110.3°110.0°
C20C19H192110.3°110.0°
C16C20H201110.1°110.0°
C16C20H202110.1°110.1°
C20C16H161113.5°110.6°
H171C17H172109.4°110.7°
H201C20H202109.5°110.0°
H112C11H111109.5°109.5°
H181C18H182109.5°110.5°
H191C19H192109.4°110.1°
H011N01H012120.0°120.0°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)		Torsion
(ideal model)
N01C02N03C08177.4°179.7°
N01C02N03C04178.3°180.0°
N01C02C08C07179.1°180.0°
N01C02C08C090.1°0.1°
C02N01H011H012180.0°180.0°
C02N03C04O05178.5°180.0°
C02N03C04N063.2°0.0°
N03C02C08C073.4°0.3°
N03C02C08C09177.3°179.8°
N03C02N01H0110.0°179.7°
N03C02N01H012180.0°0.3°
N03C04O05N06178.3°180.0°
N03C04N06C071.2°0.2°
C04N03C02C084.3°0.3°
N03C04N06H061178.8°179.7°
O05C04N06C07179.5°179.7°
O05C04N06H0610.5°0.3°
C04N06C07H061180.0°180.0°
C04N06C07C080.4°0.2°
C04N06C07H071179.6°180.0°
N06C07C08H071180.0°179.8°
N06C07C08C09179.3°180.0°
N06C07C08C021.4°0.1°
C07C08C09C02179.2°179.9°
C07C08C09C10154.4°126.0°
C08C07N06H061179.6°179.8°
C08C09C10C1120.6°70.9°
C09C08C07H0710.7°0.2°
C09C10C11N1295.1°55.2°
C10C09C08C0226.4°54.1°
C09C10C11H112145.5°64.9°
C09C10C11H11124.3°175.1°
C10C11N12H112119.5°120.0°
C10C11N12H111119.4°119.9°
C10C11N12S1389.4°165.3°
C10C11N12H12132.0°14.9°
C10C11H112H111121.7°120.0°
C11N12S13H121121.4°179.8°
C11N12S13O1447.5°178.9°
C11N12S13O15163.4°51.0°
C11N12S13C1672.9°65.1°
N12C11H112H111121.6°120.0°
N12S13O14O15117.3°116.8°
N12S13O14C16119.4°111.7°
N12S13O15C16121.8°111.7°
N12S13C16C1762.7°175.0°
N12S13C16C20179.7°60.2°
S13N12C11H112151.1°45.3°
S13N12C11H11130.0°74.8°
N12S13C16H16156.4°62.4°
O14S13O15C16122.3°131.5°
O14S13C16C17179.2°73.4°
O14S13C16C2062.2°171.8°
O14S13N12H121168.9°1.3°
O14S13C16H16161.7°49.1°
O15S13C16C1759.1°63.4°
O15S13C16C2057.9°51.4°
O15S13N12H12175.2°129.2°
O15S13C16H161178.2°174.1°
S13C16C17C20118.1°118.7°
S13C16C17H161117.4°122.5°
S13C16C17C18116.1°156.6°
S13C16C20C19130.7°142.2°
S13C16C20H161120.4°122.6°
C16S13N12H12148.5°114.8°
S13C16C17H171124.7°85.1°
S13C16C17H1723.2°38.1°
S13C16C20H201109.6°23.0°
S13C16C20H20211.1°98.4°
C16C17C18H171119.3°118.3°
C16C17C18H172119.3°118.4°
C16C17C18C1920.3°38.0°
C17C16C20C1913.7°23.6°
C17C16C20H161122.6°118.7°
C16C17H171H172122.2°123.2°
C17C16C20H201133.4°95.6°
C17C16C20H202105.9°142.9°
C16C17C18H181139.7°80.7°
C16C17C18H18299.2°156.7°
C17C18C19H181119.5°118.7°
C17C18C19H182119.4°118.8°
C17C18C19C2027.9°23.6°
C18C17C16C202.0°37.9°
C18C17H171H172122.2°123.4°
C18C17C16H161126.5°80.9°
C17C18H181H182121.6°122.6°
C17C18C19H19191.6°95.7°
C17C18C19H192147.4°142.9°
C18C19C20H191119.5°119.3°
C18C19C20H192119.5°119.2°
C18C19C20C1628.0°0.0°
C19C18C17H17199.0°156.2°
C19C18C17H172139.5°80.4°
C18C19C20H201147.6°119.3°
C18C19C20H20291.6°119.4°
C19C18H181H182121.6°122.6°
C18C19H191H192121.5°121.4°
C19C20C16H201119.6°119.2°
C19C20C16H202119.7°119.4°
C19C20H201H202121.1°121.4°
C19C20C16H161108.9°95.2°
C20C19C18H181147.3°95.0°
C20C19C18H18291.5°142.4°
C20C19H191H192121.5°121.4°
C02C08C07H071178.6°179.7°
C08C02N01H011177.5°0.0°
C08C02N01H0122.6°179.9°
C20C16C17H171117.2°156.2°
C20C16C17H172121.3°80.6°
C16C20H201H202121.1°121.5°
C16C20C19H19191.5°119.3°
C16C20C19H192147.5°119.3°
H121N12C11H11287.5°134.9°
H121N12C11H111151.5°105.0°
H171C17C16H1617.3°37.4°
H171C17C18H18120.5°37.6°
H171C17C18H182141.6°85.0°
H172C17C16H161114.2°160.6°
H172C17C18H181101.0°160.9°
H172C17C18H18220.1°38.3°
H201C20C16H16110.7°145.6°
H201C20C19H19128.1°0.0°
H201C20C19H19292.8°121.5°
H202C20C16H161131.5°24.2°
H202C20C19H191148.9°121.3°
H202C20C19H19227.9°0.1°
H071C07N06H0610.4°0.0°
H181C18C19H19127.8°145.7°
H181C18C19H19293.1°24.2°
H182C18C19H191149.0°23.1°
H182C18C19H19228.0°98.4°

225946

PDB entries from 2024-10-09

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