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88O

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
CL24C23sing1.74Å1.77Å
C22C23sing1.39Å1.40ÅAromatic
C22C21doub1.37Å1.39ÅAromatic
C23C25doub1.38Å1.39ÅAromatic
C21C20sing1.40Å1.40ÅAromatic
C25C19sing1.39Å1.39ÅAromatic
C20C19doub1.41Å1.38ÅAromatic
C20C16sing1.46Å1.40ÅAromatic
O08N07doub1.22Å1.40Å
C19N18sing1.38Å1.34ÅAromatic
C10C11doub1.38Å1.38ÅAromatic
C10C06sing1.39Å1.39ÅAromatic
N07C06sing1.48Å1.45Å
N07O09sing1.22Å1.18Å
C11C12sing1.39Å1.38ÅAromatic
C06C05doub1.38Å1.38ÅAromatic
C14N13sing1.46Å1.44Å
C14C15sing1.53Å1.53Å
C16C15sing1.51Å1.52Å
C16C17doub1.34Å1.38ÅAromatic
C12N13sing1.39Å1.44Å
C12C04doub1.40Å1.39ÅAromatic
C05C04sing1.40Å1.38ÅAromatic
C04C02sing1.47Å1.52Å
N18C17sing1.37Å1.33ÅAromatic
O01C02doub1.22Å1.26Å
C02O03sing1.35Å1.26Å
C10H1sing1.08Å1.08Å
C15H2sing1.09Å1.10Å
C15H3sing1.09Å1.10Å
C17H4sing1.08Å1.08Å
C21H5sing1.08Å1.08Å
C22H6sing1.08Å1.08Å
C05H7sing1.08Å1.08Å
C11H8sing1.08Å1.08Å
C14H9sing1.09Å1.10Å
C14H10sing1.09Å1.10Å
C25H11sing1.08Å1.08Å
N13H12sing0.97Å1.00Å
N18H13sing0.97Å1.00Å
O03H14sing0.97Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
CL24C23C22119.5°119.7°
CL24C23C25119.5°119.7°
C23C22C21120.0°120.5°
C22C23C25121.0°120.6°
C23C22H6120.0°119.7°
C22C21C20118.8°119.8°
C22C21H5120.6°120.1°
C21C22H6120.0°119.7°
C23C25C19118.9°119.8°
C23C25H11120.5°120.1°
C21C20C19120.7°119.9°
C21C20C16133.0°134.0°
C20C21H5120.6°120.1°
C25C19C20120.5°119.4°
C25C19N18131.0°133.5°
C19C25H11120.5°120.1°
C19C20C16106.3°106.1°
C20C19N18108.5°107.1°
C20C16C15126.7°126.5°
C20C16C17106.6°107.0°
O08N07C06118.8°120.0°
O08N07O09121.5°120.0°
C19N18C17109.8°109.8°
C19N18H13125.1°125.0°
C11C10C06119.5°120.4°
C10C11C12119.6°120.1°
C11C10H1120.2°119.7°
C10C11H8120.2°120.0°
C10C06N07119.7°119.8°
C10C06C05121.2°120.4°
C06C10H1120.3°119.8°
C06N07O09119.7°120.1°
N07C06C05119.1°119.8°
C11C12N13118.8°120.2°
C11C12C04120.7°119.7°
C12C11H8120.2°119.9°
C06C05C04118.9°119.9°
C06C05H7120.5°120.0°
N13C14C15108.0°109.5°
C14N13C12120.0°120.0°
N13C14H9109.9°109.5°
N13C14H10109.8°109.5°
C14N13H12106.8°120.0°
C14C15C16111.6°109.5°
C14C15H2108.9°109.5°
C14C15H3108.9°109.5°
C15C14H9109.8°109.4°
C15C14H10109.8°109.4°
C15C16C17126.7°126.5°
C16C15H2108.9°109.4°
C16C15H3108.9°109.5°
C16C17N18108.9°109.9°
C16C17H4125.6°125.0°
N13C12C04120.5°120.1°
C12N13H12106.8°120.0°
C12C04C05120.1°119.5°
C12C04C02122.2°120.3°
C05C04C02117.7°120.2°
C04C05H7120.6°120.1°
C04C02O01120.6°119.9°
C04C02O03118.8°120.0°
N18C17H4125.6°125.0°
C17N18H13125.1°125.1°
O01C02O03120.6°120.0°
C02O03H14109.5°117.0°
H2C15H3109.5°109.4°
H9C14H10109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
CL24C23C22C25178.6°180.0°
CL24C23C22C21179.4°180.0°
CL24C23C25C19179.3°180.0°
CL24C23C22H60.6°0.1°
CL24C23C25H110.7°0.1°
C23C22C21H6180.0°179.9°
C23C22C21C200.9°0.0°
C22C23C25C190.7°0.0°
C23C22C21H5179.1°179.9°
C22C23C25H11179.3°179.9°
C21C22C23C250.7°0.0°
C22C21C20H5180.0°179.9°
C22C21C20C191.0°0.1°
C22C21C20C16179.9°180.0°
C23C25C19H11180.0°179.9°
C23C25C19C200.7°0.1°
C23C25C19N18179.6°180.0°
C25C23C22H6179.3°179.9°
C21C20C19C250.9°0.1°
C21C20C19C16179.3°179.9°
C21C20C19N18179.3°180.0°
C21C20C16C150.5°0.1°
C21C20C16C17179.1°179.9°
C20C21C22H6179.1°179.9°
C25C19C20N18179.8°179.9°
C25C19C20C16179.8°179.9°
C25C19N18C17179.9°179.7°
C25C19N18H130.1°0.1°
C19C20C16C15179.7°179.8°
C19C20C16C170.1°0.2°
C20C19N18C170.1°0.1°
C19C20C21H5179.0°180.0°
C20C19C25H11179.2°180.0°
C20C19N18H13179.9°180.0°
C16C20C19N180.0°0.0°
C20C16C15C1465.6°85.0°
C20C16C15C17179.5°180.0°
C20C16C17N180.2°0.3°
C20C16C15H254.7°35.0°
C20C16C15H3174.1°155.0°
C20C16C17H4179.8°180.0°
C16C20C21H50.1°0.1°
O08N07C06C1018.7°180.0°
O08N07C06O09178.4°179.9°
O08N07C06C05160.1°0.1°
C19N18C17C160.2°0.3°
C19N18C17H13180.0°179.8°
C19N18C17H4179.8°180.0°
N18C19C25H110.4°0.1°
C11C10C06H1180.0°179.7°
C11C10C06N07179.3°180.0°
C10C11C12H8180.0°180.0°
C11C10C06C050.5°0.0°
C10C11C12N13179.7°180.0°
C10C11C12C040.1°0.0°
C10C06N07C05178.8°180.0°
C10C06N07O09162.9°0.0°
C06C10C11C120.1°0.0°
C10C06C05C040.8°0.0°
C10C06C05H7179.2°180.0°
C06C10C11H8179.9°180.0°
N07C06C05C04179.6°180.0°
N07C06C10H10.7°0.3°
N07C06C05H70.4°0.0°
O09N07C06C0518.3°180.0°
C11C12N13C143.6°5.6°
C11C12N13C04179.8°180.0°
C11C12C04C050.4°0.0°
C11C12C04C02179.7°180.0°
C12C11C10H1179.9°179.7°
C11C12N13H12117.9°174.4°
C06C05C04C120.8°0.0°
C06C05C04H7180.0°180.0°
C06C05C04C02179.9°180.0°
C05C06C10H1179.5°179.7°
N13C14C15H9119.8°120.0°
N13C14C15H10119.7°120.1°
N13C14C15C16178.0°180.0°
C14N13C12H12121.5°180.0°
C14N13C12C04176.1°174.4°
N13C14C15H261.7°60.0°
N13C14C15H357.7°60.0°
N13C14H9H10120.7°120.0°
C14C15C16H2120.3°120.0°
C14C15C16H3120.3°120.1°
C14C15C16C17114.9°95.0°
C15C14N13C12175.7°180.0°
C14C15H2H3119.0°120.0°
C15C14H9H10120.7°119.9°
C15C14N13H1254.2°0.0°
C15C16C17N18179.7°179.7°
C16C15H2H3119.0°120.0°
C15C16C17H40.2°0.1°
C16C15C14H958.2°59.9°
C16C15C14H1062.3°60.0°
C16C17N18H4180.0°179.7°
C17C16C15H2124.8°145.0°
C17C16C15H35.4°25.1°
C16C17N18H13179.8°179.9°
N13C12C04C05179.3°180.0°
N13C12C04C020.1°0.0°
N13C12C11H80.3°0.1°
C12N13C14H956.0°60.0°
C12N13C14H1064.5°60.0°
C12C04C05C02179.3°180.0°
C12C04C02O0115.8°5.9°
C12C04C02O03164.8°174.1°
C12C04C05H7179.2°180.0°
C04C12C11H8179.9°180.0°
C04C12N13H1262.4°5.6°
C05C04C02O01163.5°174.2°
C05C04C02O0316.0°5.9°
C04C02O01O03179.4°180.0°
C02C04C05H70.1°0.0°
C04C02O03H14179.4°180.0°
O01C02O03H140.0°0.1°
H1C10C11H80.1°0.3°
H2C15C14H9178.5°60.0°
H2C15C14H1058.0°180.0°
H3C15C14H962.1°180.0°
H3C15C14H10177.4°60.1°
H4C17N18H130.2°0.2°
H5C21C22H60.9°0.0°
H9C14N13H1265.5°120.0°
H10C14N13H12174.0°120.0°

223532

PDB entries from 2024-08-07

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