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KYP

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
O2C13doub1.22Å1.20Å
C22C23doub1.38Å1.38ÅAromatic
C22C12sing1.40Å1.39ÅAromatic
C13C12sing1.48Å1.50Å
C13N1sing1.35Å1.35Å
C23C9sing1.38Å1.39ÅAromatic
C12C11doub1.40Å1.39ÅAromatic
C21N1sing1.47Å1.47Å
C21C20sing1.53Å1.51Å
N1C14sing1.47Å1.47Å
C9C8sing1.51Å1.46Å
C9C10doub1.38Å1.40ÅAromatic
O1C6sing1.36Å1.28Å
C11C10sing1.38Å1.38ÅAromatic
C8C7sing1.51Å1.34Å
C20N2sing1.47Å1.46Å
C6C7doub1.34Å1.46ÅAromatic
C6C5sing1.47Å1.46ÅAromatic
C7O3sing1.35Å1.39ÅAromatic
C14C15sing1.54Å1.50Å
N2C15sing1.47Å1.47Å
N2C16sing1.38Å1.36Å
N4C16doub1.32Å1.35ÅAromatic
N4C19sing1.32Å1.34ÅAromatic
C5C4doub1.39Å1.39ÅAromatic
C5C24sing1.40Å1.40ÅAromatic
O3C24sing1.35Å1.38ÅAromatic
C16N3sing1.33Å1.35ÅAromatic
C4C3sing1.38Å1.38ÅAromatic
C19C18doub1.39Å1.38ÅAromatic
C24C1doub1.40Å1.39ÅAromatic
N3C17doub1.32Å1.34ÅAromatic
C3C2doub1.38Å1.39ÅAromatic
C18C17sing1.39Å1.38ÅAromatic
C1C2sing1.39Å1.40ÅAromatic
C1Csing1.47Å1.50Å
NCsing1.35Å1.35Å
COdoub1.22Å1.26Å
C21H1sing1.09Å1.10Å
C21H2sing1.09Å1.10Å
C20H3sing1.09Å1.10Å
C20H4sing1.09Å1.10Å
C19H5sing1.08Å1.08Å
C18H6sing1.08Å1.08Å
C17H7sing1.08Å1.08Å
C15H8sing1.09Å1.10Å
C15H9sing1.09Å1.10Å
C14H10sing1.09Å1.10Å
C14H11sing1.09Å1.10Å
C11H12sing1.08Å1.08Å
C10H13sing1.08Å1.08Å
C22H14sing1.08Å1.08Å
C23H15sing1.08Å1.08Å
C8H16sing1.09Å1.10Å
C8H17sing1.09Å1.10Å
NH19sing0.97Å1.00Å
NH20sing0.97Å1.00Å
C4H21sing1.08Å1.08Å
C3H22sing1.08Å1.08Å
C2H23sing1.08Å1.08Å
O1H18sing0.97Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
O2C13C12118.6°120.0°
O2C13N1121.2°120.0°
C23C22C12120.7°119.8°
C22C23C9121.3°120.2°
C23C22H14119.6°120.1°
C22C23H15119.3°119.9°
C22C12C13119.7°120.1°
C22C12C11118.3°119.7°
C12C22H14119.6°120.1°
C12C13N1120.2°120.0°
C13C12C11122.0°120.1°
C13N1C21119.8°120.9°
C13N1C14127.4°120.9°
C23C9C8117.3°119.8°
C23C9C10117.8°120.3°
C9C23H15119.3°119.9°
C12C11C10120.8°119.9°
C12C11H12119.6°120.1°
N1C21C20110.5°108.5°
C21N1C14112.7°118.2°
N1C21H1109.2°109.6°
N1C21H2109.2°109.7°
C21C20N2109.5°109.3°
C20C21H1109.2°109.6°
C20C21H2109.2°109.7°
C21C20H3109.4°109.5°
C21C20H4109.5°109.5°
N1C14C15110.8°108.3°
N1C14H10109.1°109.6°
N1C14H11109.1°109.6°
C8C9C10124.7°119.8°
C9C8C7131.1°109.5°
C9C8H16103.8°109.5°
C9C8H17103.8°109.5°
C9C10C11121.1°120.1°
C9C10H13119.5°119.9°
O1C6C7126.7°127.0°
O1C6C5129.0°126.9°
C6O1H18109.5°114.0°
C10C11H12119.6°120.0°
C11C10H13119.5°119.9°
C8C7C6125.6°124.9°
C8C7O3124.3°125.0°
C7C8H16103.8°109.5°
C7C8H17103.8°109.4°
C20N2C15111.8°111.3°
C20N2C16123.9°111.0°
N2C20H3109.5°109.5°
N2C20H4109.5°109.5°
C7C6C5104.2°106.1°
C6C7O3109.6°110.0°
C6C5C4131.7°134.3°
C6C5C24107.5°105.5°
C7O3C24107.8°111.0°
C14C15N2110.3°109.2°
C14C15H8109.3°109.6°
C14C15H9109.3°109.4°
C15C14H10109.1°109.8°
C15C14H11109.2°109.7°
C15N2C16124.1°111.0°
N2C15H8109.2°109.5°
N2C15H9109.3°109.5°
N2C16N4116.7°119.2°
N2C16N3116.8°119.2°
C16N4C19115.3°120.8°
N4C16N3126.5°121.5°
N4C19C18123.5°119.2°
N4C19H5118.3°120.4°
C4C5C24120.7°120.2°
C5C4C3118.5°119.9°
C5C4H21120.7°120.1°
C5C24O3110.8°107.4°
C5C24C1121.0°119.2°
O3C24C1128.0°133.4°
C16N3C17115.0°120.8°
C4C3C2120.9°120.5°
C3C4H21120.7°120.0°
C4C3H22119.5°119.8°
C19C18C17116.1°118.6°
C18C19H5118.2°120.4°
C19C18H6121.9°120.8°
C24C1C2117.6°119.6°
C24C1C124.5°120.2°
N3C17C18123.5°119.2°
N3C17H7118.2°120.4°
C3C2C1121.3°120.5°
C2C3H22119.6°119.7°
C3C2H23119.4°119.7°
C17C18H6121.9°120.7°
C18C17H7118.3°120.4°
C2C1C117.8°120.2°
C1C2H23119.4°119.8°
C1CN117.9°120.0°
C1CO120.3°120.0°
NCO121.7°120.0°
CNH19120.0°120.0°
CNH20120.0°120.0°
H1C21H2109.5°109.8°
H3C20H4109.5°109.6°
H8C15H9109.5°109.5°
H10C14H11109.5°109.8°
H16C8H17109.5°109.4°
H19NH20120.0°120.0°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
O2C13C12C2259.7°130.6°
O2C13C12N1178.3°179.7°
O2C13C12C11121.6°49.2°
O2C13N1C212.7°175.8°
O2C13N1C14178.2°3.8°
C23C22C12H14180.0°179.9°
C23C22C12C13177.9°180.0°
C22C23C9H15180.0°180.0°
C23C22C12C110.9°0.2°
C22C23C9C8173.6°180.0°
C22C23C9C101.1°0.3°
C22C12C13C11178.8°179.8°
C22C12C13N1118.6°49.7°
C12C22C23C90.2°0.1°
C22C12C11C100.2°0.2°
C22C12C11H12179.8°179.8°
C12C22C23H15179.8°180.0°
C12C13N1C21175.6°4.4°
C12C13N1C140.1°175.9°
C13C12C11C10178.6°180.0°
C13C12C11H121.4°0.0°
C13C12C22H142.1°0.1°
N1C13C12C1160.1°130.5°
C13N1C21C14176.1°179.6°
C13N1C21C20129.0°128.8°
C13N1C14C15130.3°128.8°
C13N1C21H18.8°9.2°
C13N1C21H2110.9°111.4°
C13N1C14H10109.5°111.4°
C13N1C14H1110.1°9.2°
C23C9C8C10174.3°179.7°
C23C9C10C111.8°0.3°
C23C9C8C7168.5°90.0°
C23C9C10H13178.2°179.7°
C9C23C22H14179.8°180.0°
C23C9C8H1668.7°150.0°
C23C9C8H1745.7°30.0°
C12C11C10C91.2°0.0°
C12C11C10H12180.0°180.0°
C12C11C10H13178.9°180.0°
C11C12C22H14179.1°179.7°
N1C21C20H1120.2°119.6°
N1C21C20H2120.1°119.7°
N1C21C20N256.3°53.9°
C21N1C14C1553.9°51.6°
N1C21H1H2119.5°120.5°
N1C21C20H363.7°66.1°
N1C21C20H4176.3°173.8°
C21N1C14H1066.2°68.2°
C21N1C14H11174.2°171.2°
C20C21N1C1454.9°51.5°
C21C20N2H3120.0°120.0°
C21C20N2H4120.0°119.9°
C21C20N2C1559.0°63.1°
C21C20N2C16125.1°172.8°
C20C21H1H2119.5°120.5°
C21C20H3H4120.0°120.1°
N1C14C15H10120.2°119.7°
N1C14C15H11120.2°119.6°
N1C14C15N254.5°54.1°
C14N1C21H1175.1°171.2°
C14N1C21H265.2°68.2°
N1C14C15H8174.6°65.9°
N1C14C15H965.6°174.0°
N1C14H10H11119.4°120.5°
C8C9C10C11172.5°180.0°
C9C8C7H16122.8°120.0°
C9C8C7H17122.8°120.0°
C9C8C7C6154.4°90.3°
C9C8C7O334.0°90.0°
C8C9C10H137.5°0.0°
C8C9C23H156.4°0.0°
C9C8H16H17110.3°120.0°
C9C10C11H13180.0°180.0°
C10C9C8C717.2°90.3°
C9C10C11H12178.8°179.9°
C10C9C23H15178.9°179.7°
C10C9C8H16105.6°29.7°
C10C9C8H17140.0°149.7°
O1C6C7C811.1°0.0°
O1C6C7C5177.7°179.9°
O1C6C7O3176.2°179.8°
O1C6C5C49.9°0.1°
O1C6C5C24175.3°179.8°
C8C7C6O3172.7°179.7°
C8C7C6C5171.2°180.0°
C8C7O3C24172.7°180.0°
C7C8H16H17110.4°119.9°
C20N2C15C1458.3°63.3°
C20N2C15C16175.9°124.1°
C20N2C16N45.2°0.3°
C20N2C16N3175.8°180.0°
N2C20C21H1176.5°173.5°
N2C20C21H263.9°65.9°
N2C20H3H4120.0°120.1°
C20N2C15H8178.4°56.8°
C20N2C15H961.8°176.9°
C7C6C5C4172.5°180.0°
C7C6C5C242.3°0.2°
C6C7O3C240.0°0.3°
C6C7C8H1682.9°29.7°
C6C7C8H1731.6°149.7°
C7C6O1H18180.0°90.0°
C5C6C7O31.5°0.3°
C6C5C4C24174.2°179.7°
C6C5C24O32.5°0.1°
C6C5C4C3175.4°180.0°
C6C5C24C1178.3°179.8°
C6C5C4H214.6°0.1°
C5C6O1H182.9°90.1°
C7O3C24C51.5°0.1°
C7O3C24C1177.0°179.9°
O3C7C8H1688.8°150.0°
O3C7C8H17156.8°30.0°
C14C15N2H8120.1°120.1°
C14C15N2H9120.1°119.8°
C14C15N2C16125.8°172.6°
C14C15H8H9119.6°120.0°
C15C14H10H11119.4°120.7°
C15N2C16N4179.4°124.6°
C15N2C16N30.4°55.7°
C15N2C20H361.0°56.8°
C15N2C20H4179.0°176.9°
N2C15H8H9119.6°120.1°
N2C15C14H1065.7°65.6°
N2C15C14H11174.7°173.6°
N2C16N4N3178.9°179.7°
N2C16N4C19177.6°180.0°
N2C16N3C17177.5°179.8°
C16N2C20H3114.9°67.3°
C16N2C20H45.1°52.8°
C16N2C15H85.7°67.3°
C16N2C15H9114.1°52.8°
C16N4C19C180.0°0.0°
N4C16N3C171.4°0.5°
C16N4C19H5180.0°179.9°
C19N4C16N31.3°0.3°
N4C19C18H5180.0°179.9°
N4C19C18C171.0°0.1°
N4C19C18H6179.0°180.0°
C4C5C24O3173.0°179.9°
C5C4C3H21180.0°179.9°
C4C5C24C12.8°0.0°
C5C4C3C20.7°0.3°
C5C4C3H22179.3°180.0°
C5C24O3C1175.5°179.8°
C24C5C4C31.1°0.3°
C5C24C1C22.6°0.2°
C5C24C1C175.2°179.9°
C24C5C4H21178.9°179.8°
O3C24C1C2172.5°180.0°
O3C24C1C9.7°0.1°
C16N3C17C180.2°0.5°
C16N3C17H7179.8°179.7°
C4C3C2H22180.0°179.7°
C4C3C2C10.9°0.1°
C4C3C2H23179.0°179.8°
C19C18C17N30.9°0.2°
C19C18C17H6180.0°179.9°
C19C18C17H7179.1°180.0°
C24C1C2C30.7°0.1°
C24C1C2C177.9°179.9°
C24C1CN10.0°179.9°
C24C1CO166.6°0.0°
C24C1C2H23179.3°180.0°
N3C17C18H7180.0°179.8°
N3C17C18H6179.1°179.8°
C3C2C1H23180.0°179.9°
C3C2C1C177.2°179.9°
C2C3C4H21179.3°179.8°
C17C18C19H5179.0°180.0°
C2C1CN172.2°0.0°
C2C1CO11.2°179.9°
C1C2C3H22179.1°179.8°
C1CNO176.6°179.9°
C1CNH19176.5°0.1°
C1CNH203.4°180.0°
CC1C2H232.8°0.0°
CNH19H20180.0°179.9°
OCNH190.0°180.0°
OCNH20180.0°0.1°
H1C21C20H356.5°53.6°
H1C21C20H463.6°66.6°
H2C21C20H3176.1°174.2°
H2C21C20H456.1°54.0°
H5C19C18H61.0°0.1°
H6C18C17H70.9°0.1°
H8C15C14H1054.4°174.4°
H8C15C14H1165.2°53.7°
H9C15C14H10174.2°54.4°
H9C15C14H1154.6°66.4°
H12C11C10H131.2°0.0°
H14C22C23H150.2°0.1°
H21C4C3H220.8°0.0°
H22C3C2H231.0°0.1°

222624

PDB entries from 2024-07-17

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