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VKQ

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C22N4sing1.46Å1.46Å
N4C21sing1.35Å1.33Å
N3C20doub1.31Å1.34ÅAromatic
N3C19sing1.33Å1.35ÅAromatic
C21O1doub1.21Å1.23Å
C21C19sing1.48Å1.51Å
C20C16sing1.40Å1.39ÅAromatic
C19C18doub1.40Å1.39ÅAromatic
C16N2sing1.39Å1.39Å
C16C17doub1.39Å1.40ÅAromatic
C18C17sing1.38Å1.38ÅAromatic
C12C13sing1.53Å1.52Å
C12N1sing1.47Å1.48Å
C6C5doub1.37Å1.38ÅAromatic
C6C7sing1.39Å1.40ÅAromatic
N2C13sing1.47Å1.47Å
N2C14sing1.47Å1.47Å
C15C14sing1.53Å1.53Å
C15N1sing1.47Å1.48Å
C5C4sing1.40Å1.40ÅAromatic
C11N1sing1.47Å1.47Å
C11C7sing1.51Å1.52Å
C7C8doub1.38Å1.40ÅAromatic
C4C3sing1.46Å1.42Å
C4C9doub1.41Å1.41ÅAromatic
C3C2doub1.36Å1.36Å
C8C9sing1.39Å1.40ÅAromatic
C9Nsing1.38Å1.39Å
CC1sing1.53Å1.54Å
C2C1sing1.51Å1.51Å
C2C10sing1.41Å1.46Å
NC10sing1.35Å1.36Å
C10Odoub1.22Å1.23Å
C1H1sing1.09Å1.10Å
C1H2sing1.09Å1.10Å
C3H3sing1.08Å1.08Å
C8H4sing1.08Å1.08Å
C11H5sing1.09Å1.10Å
C11H6sing1.09Å1.10Å
C12H7sing1.09Å1.10Å
C12H8sing1.09Å1.10Å
C13H9sing1.09Å1.10Å
C13H10sing1.09Å1.10Å
C14H11sing1.09Å1.10Å
C14H12sing1.09Å1.10Å
C15H13sing1.09Å1.10Å
C15H14sing1.09Å1.10Å
C20H15sing1.08Å1.08Å
C22H16sing1.09Å1.10Å
C22H17sing1.09Å1.10Å
C22H18sing1.09Å1.10Å
N4H19sing0.97Å1.00Å
C18H20sing1.08Å1.08Å
C17H21sing1.08Å1.08Å
C6H23sing1.08Å1.08Å
C5H24sing1.08Å1.08Å
NH25sing0.97Å1.00Å
CH26sing1.09Å1.10Å
CH27sing1.09Å1.10Å
CH28sing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C22N4C21122.2°120.0°
N4C22H16109.5°109.5°
N4C22H17109.5°109.5°
N4C22H18109.5°109.4°
C22N4H19118.9°120.0°
N4C21O1123.1°120.1°
N4C21C19115.7°120.0°
C21N4H19118.9°120.0°
C20N3C19117.9°121.8°
N3C20C16123.5°120.8°
N3C20H15118.3°119.7°
N3C19C21117.3°119.7°
N3C19C18122.9°120.7°
O1C21C19121.3°120.0°
C21C19C18119.8°119.6°
C20C16N2120.7°120.4°
C20C16C17117.6°119.2°
C16C20H15118.2°119.6°
C19C18C17118.2°119.2°
C19C18H20120.9°120.4°
N2C16C17121.8°120.4°
C16N2C13118.7°111.0°
C16N2C14120.6°111.0°
C16C17C18119.8°118.4°
C16C17H21120.1°120.8°
C17C18H20120.9°120.4°
C18C17H21120.1°120.8°
C13C12N1110.4°109.4°
C12C13N2110.1°109.3°
C13C12H7109.3°109.5°
C13C12H8109.3°109.4°
C12C13H9109.3°109.5°
C12C13H10109.3°109.5°
C12N1C15109.1°110.9°
C12N1C11111.3°111.0°
N1C12H7109.2°109.5°
N1C12H8109.2°109.5°
C5C6C7121.0°120.6°
C6C5C4120.8°119.7°
C5C6H23119.5°119.7°
C6C5H24119.6°120.1°
C6C7C11120.0°119.7°
C6C7C8119.0°120.7°
C7C6H23119.5°119.7°
C13N2C14113.4°110.9°
N2C13H9109.3°109.5°
N2C13H10109.3°109.5°
N2C14C15110.9°109.3°
N2C14H11109.1°109.4°
N2C14H12109.1°109.5°
C14C15N1111.2°109.4°
C15C14H11109.1°109.5°
C15C14H12109.1°109.5°
C14C15H13109.1°109.5°
C14C15H14109.0°109.4°
C15N1C11110.1°111.0°
N1C15H13109.0°109.5°
N1C15H14109.0°109.5°
C5C4C3123.9°121.2°
C5C4C9118.3°119.8°
C4C5H24119.6°120.1°
N1C11C7117.0°109.5°
N1C11H5107.6°109.5°
N1C11H6107.6°109.6°
C11C7C8121.0°119.6°
C7C11H5107.5°109.4°
C7C11H6107.6°109.5°
C7C8C9120.0°119.8°
C7C8H4120.0°120.1°
C3C4C9117.8°119.0°
C4C3C2121.9°118.5°
C4C3H3119.1°120.7°
C4C9C8121.0°119.4°
C4C9N118.8°119.6°
C3C2C1122.5°119.9°
C3C2C10120.4°120.2°
C2C3H3119.0°120.8°
C8C9N120.2°121.0°
C9C8H4120.0°120.1°
C9NC10125.3°120.9°
C9NH25117.4°119.5°
CC1C2115.2°109.5°
CC1H1108.0°109.4°
CC1H2108.0°109.4°
C1CH26109.5°109.4°
C1CH27109.5°109.4°
C1CH28109.5°109.4°
C1C2C10117.0°119.9°
C2C1H1108.0°109.5°
C2C1H2108.0°109.5°
C2C10N115.7°121.7°
C2C10O124.5°119.2°
NC10O119.7°119.1°
C10NH25117.4°119.5°
H1C1H2109.5°109.5°
H5C11H6109.4°109.4°
H7C12H8109.4°109.5°
H9C13H10109.5°109.5°
H11C14H12109.5°109.5°
H13C15H14109.5°109.5°
H16C22H17109.5°109.5°
H16C22H18109.4°109.4°
H17C22H18109.5°109.5°
H26CH27109.5°109.5°
H26CH28109.5°109.5°
H27CH28109.4°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C22N4C21H19180.0°180.0°
C22N4C21O14.7°0.0°
C22N4C21C19175.7°180.0°
N4C22H16H17120.0°120.1°
N4C22H16H18120.0°120.0°
N4C22H17H18120.0°120.0°
N4C21C19N30.5°0.3°
N4C21O1C19179.6°180.0°
N4C21C19C18179.8°180.0°
C21N4C22H16180.0°60.0°
C21N4C22H1760.0°180.0°
C21N4C22H1860.0°60.0°
C20N3C19C21179.9°180.0°
N3C20C16H15180.0°180.0°
C20N3C19C180.2°0.2°
N3C20C16N2179.7°180.0°
N3C20C16C170.1°0.2°
N3C19C21O1179.1°179.7°
N3C19C21C18179.7°179.8°
C19N3C20C160.0°0.0°
N3C19C18C170.2°0.2°
C19N3C20H15180.0°179.9°
N3C19C18H20179.8°179.7°
O1C21C19C180.5°0.0°
O1C21N4H19175.3°180.0°
C21C19C18C17179.8°179.9°
C19C21N4H194.3°0.0°
C21C19C18H200.2°0.0°
C20C16N2C17179.6°179.7°
C20C16C17C180.1°0.3°
C20C16N2C1336.7°0.3°
C20C16N2C14175.1°123.5°
C20C16C17H21179.9°179.8°
C19C18C17C160.0°0.1°
C19C18C17H20180.0°179.9°
C19C18C17H21180.0°180.0°
N2C16C17C18179.7°180.0°
C16N2C13C12155.4°176.8°
C16N2C13C14150.5°123.9°
C16N2C14C15158.1°176.8°
C16N2C13H935.3°56.8°
C16N2C13H1084.5°63.2°
C16N2C14H1137.9°63.2°
C16N2C14H1281.7°56.8°
N2C16C20H150.3°0.1°
N2C16C17H210.3°0.0°
C16C17C18H21180.0°179.9°
C17C16N2C13143.8°180.0°
C17C16N2C144.5°56.2°
C17C16C20H15179.9°179.8°
C16C17C18H20180.0°180.0°
C13C12N1H7120.2°120.0°
C13C12N1H8120.2°119.9°
C12C13N2H9120.1°120.0°
C12C13N2H10120.1°119.9°
C12C13N2C1454.1°59.3°
C13C12N1C1560.8°59.3°
C13C12N1C11177.5°176.8°
C13C12H7H8119.6°120.0°
C12C13H9H10119.7°120.1°
N1C12C13N258.2°58.4°
C12N1C15C1458.6°59.4°
C12N1C15C11122.4°123.9°
C12N1C11C764.3°170.0°
C12N1C11H556.7°70.1°
C12N1C11H6174.6°49.9°
N1C12H7H8119.6°120.1°
N1C12C13H9178.3°178.3°
N1C12C13H1061.9°61.6°
C12N1C15H1361.7°60.7°
C12N1C15H14178.9°179.3°
C5C6C7H23180.0°179.6°
C6C5C4H24180.0°180.0°
C5C6C7C11179.7°179.9°
C5C6C7C81.1°0.6°
C6C5C4C3179.7°180.0°
C6C5C4C90.5°0.0°
C7C6C5C40.8°0.3°
C6C7C11N197.2°90.5°
C6C7C11C8178.6°179.5°
C6C7C8C91.1°0.6°
C6C7C8H4178.9°180.0°
C6C7C11H523.9°29.5°
C6C7C11H6141.7°149.4°
C7C6C5H24179.2°179.7°
C13N2C14C1552.0°59.3°
N2C13C12H7178.4°178.4°
N2C13C12H861.9°61.6°
N2C13H9H10119.8°120.1°
C13N2C14H11172.2°60.6°
C13N2C14H1268.2°179.3°
N2C14C15H11120.2°119.9°
N2C14C15H12120.2°120.0°
N2C14C15N154.0°58.4°
C14N2C13H9174.2°179.3°
C14N2C13H1066.0°60.6°
N2C14H11H12119.3°120.1°
N2C14C15H1366.3°61.6°
N2C14C15H14174.2°178.4°
C14C15N1H13120.3°120.0°
C14C15N1H14120.3°119.9°
C14C15N1C11179.0°176.8°
C15C14H11H12119.3°120.1°
C14C15H13H14119.2°120.0°
C15N1C11C7174.5°66.2°
C15N1C11H564.4°53.7°
C15N1C11H653.4°173.7°
C15N1C12H7179.0°179.3°
C15N1C12H859.4°60.6°
N1C15C14H11174.2°61.5°
N1C15C14H1266.3°178.4°
N1C15H13H14119.2°120.0°
C5C4C3C9179.8°180.0°
C5C4C3C2179.8°180.0°
C5C4C9C80.5°0.0°
C5C4C9N179.8°179.7°
C5C4C3H30.2°0.1°
C4C5C6H23179.2°179.9°
N1C11C7H5121.1°120.0°
N1C11C7H6121.1°120.1°
N1C11C7C884.2°90.0°
N1C11H5H6116.6°120.1°
C11N1C12H757.3°56.8°
C11N1C12H862.3°63.3°
C11N1C15H1360.8°63.2°
C11N1C15H1458.7°56.9°
C11C7C8C9179.7°179.9°
C11C7C8H40.3°0.5°
C7C11H5H6116.6°120.0°
C11C7C6H230.3°0.3°
C7C8C9C40.8°0.3°
C7C8C9H4180.0°179.4°
C7C8C9N179.9°180.0°
C8C7C11H5154.6°150.0°
C8C7C11H636.8°30.1°
C8C7C6H23178.9°179.8°
C4C3C2H3180.0°179.9°
C3C4C9C8179.7°180.0°
C3C4C9N0.3°0.3°
C4C3C2C1180.0°180.0°
C4C3C2C100.3°0.3°
C3C4C5H240.3°0.0°
C9C4C3C20.0°0.0°
C4C9C8N179.3°179.7°
C4C9NC100.4°0.3°
C9C4C3H3180.0°179.9°
C4C9C8H4179.2°179.7°
C9C4C5H24179.5°180.0°
C4C9NH25179.6°180.0°
C3C2C1C2.9°95.3°
C3C2C1C10179.8°179.7°
C3C2C10N0.2°0.2°
C3C2C10O179.9°179.8°
C3C2C1H1117.9°144.8°
C3C2C1H2123.7°24.7°
C8C9NC10179.8°180.0°
C8C9NH250.2°0.4°
C9NC10C20.1°0.1°
C9NC10H25180.0°179.6°
C9NC10O179.7°179.9°
NC9C8H40.1°0.6°
CC1C2H1120.8°120.0°
CC1C2H2120.8°120.0°
CC1C2C10176.9°85.0°
CC1H1H2117.4°120.0°
C1CH26H27120.0°120.0°
C1CH26H28120.0°120.0°
C1CH27H28120.0°120.0°
C1C2C10N180.0°180.0°
C1C2C10O0.2°0.0°
C2C1H1H2117.4°120.0°
C1C2C3H30.1°0.1°
C2C1CH26180.0°60.0°
C2C1CH2760.0°60.0°
C2C1CH2860.0°180.0°
C2C10NO179.8°180.0°
C10C2C1H162.3°35.0°
C10C2C1H256.1°155.0°
C10C2C3H3179.7°179.8°
C2C10NH25179.9°179.7°
OC10NH250.3°0.3°
H1C1CH2659.2°180.0°
H1C1CH2760.8°60.0°
H1C1CH28179.2°60.0°
H2C1CH2659.1°60.0°
H2C1CH27179.2°NaN°
H2C1CH2860.9°60.0°
H7C12C13H961.6°61.6°
H7C12C13H1058.2°58.4°
H8C12C13H958.1°58.4°
H8C12C13H10177.9°178.4°
H11C14C15H1353.9°178.5°
H11C14C15H1465.6°58.5°
H12C14C15H13173.5°58.4°
H12C14C15H1454.0°61.6°
H16C22H17H18120.0°120.0°
H16C22N4H190.0°120.0°
H17C22N4H19120.0°0.0°
H18C22N4H19120.0°120.1°
H20C18C17H210.0°0.1°
H23C6C5H240.8°0.1°
H26CH27H28120.0°120.1°

225946

PDB entries from 2024-10-09

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