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A1ETK

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
N20C21doub1.31Å1.32ÅAromatic
N20N19sing1.40Å1.38ÅAromatic
C21C17sing1.41Å1.42ÅAromatic
O08C04sing1.36Å1.39Å
C03C04doub1.38Å1.39ÅAromatic
C03C02sing1.39Å1.38ÅAromatic
N19C25sing1.47Å1.37Å
N19C18sing1.35Å1.30ÅAromatic
C17C02sing1.49Å1.53Å
C17C18doub1.36Å1.44ÅAromatic
C25C24sing1.53Å1.39Å
C04C05sing1.39Å1.38ÅAromatic
O14S13doub1.42Å1.47Å
C02C01doub1.39Å1.38ÅAromatic
C18C22sing1.51Å1.43Å
C24C23sing1.53Å1.40Å
C05N09sing1.40Å1.44Å
C05C06doub1.39Å1.38ÅAromatic
C01C06sing1.38Å1.39ÅAromatic
S13N09sing1.67Å1.69Å
S13N12sing1.67Å1.66Å
S13O15doub1.42Å1.47Å
N09C10sing1.47Å1.41Å
C22C23sing1.54Å1.40Å
C06F07sing1.35Å1.37Å
N12C11sing1.34Å1.38Å
C10C11sing1.49Å1.69Å
C11O16doub1.21Å1.20Å
C10H1sing1.09Å1.10Å
C10H2sing1.09Å1.10Å
N12H3sing0.97Å1.00Å
C21H4sing1.08Å1.08Å
C22H5sing1.09Å1.10Å
C24H6sing1.09Å1.10Å
C01H7sing1.08Å1.08Å
C03H8sing1.08Å1.08Å
C23H9sing1.09Å1.10Å
C25H10sing1.09Å1.10Å
O08H11sing0.97Å0.95Å
C22H12sing1.09Å1.10Å
C24H13sing1.09Å1.10Å
C23H14sing1.09Å1.10Å
C25H15sing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C21N20N19110.3°108.5°
N20C21C17107.1°108.2°
N20C21H4126.4°125.9°
N20N19C25128.0°127.4°
N20N19C18109.9°108.1°
C21C17C02127.9°126.3°
C21C17C18104.9°107.4°
C17C21H4126.5°125.9°
O08C04C03120.4°120.0°
O08C04C05118.7°120.0°
C04O08H11109.5°114.0°
C04C03C02119.2°120.0°
C03C04C05120.9°120.0°
C04C03H8120.4°120.0°
C03C02C17118.0°120.0°
C03C02C01119.9°120.0°
C02C03H8120.4°120.0°
C25N19C18122.1°124.4°
N19C25C24120.7°108.8°
N19C25H10106.6°109.6°
N19C25H15106.6°109.6°
N19C18C17107.8°107.8°
N19C18C22120.3°124.4°
C02C17C18127.2°126.3°
C17C02C01122.1°120.0°
C17C18C22131.9°127.8°
C25C24C23118.7°109.6°
C25C24H6107.1°109.4°
C24C25H10106.6°109.6°
C25C24H13107.1°109.5°
C24C25H15106.6°109.6°
C04C05N09116.3°120.0°
C04C05C06120.2°120.0°
O14S13N09104.4°107.1°
O14S13N12107.8°107.1°
O14S13O15115.6°123.9°
C02C01C06120.9°120.0°
C02C01H7119.5°120.0°
C18C22C23119.1°108.2°
C18C22H5107.0°109.7°
C18C22H12107.0°109.7°
C24C23C22119.1°109.1°
C23C24H6107.1°109.5°
C24C23H9107.0°109.6°
C23C24H13107.1°109.4°
C24C23H14107.0°109.5°
N09C05C06123.4°120.0°
C05N09S13127.7°127.9°
C05N09C10124.1°127.9°
C05C06C01118.8°120.1°
C05C06F07120.2°120.0°
C01C06F07121.0°120.0°
C06C01H7119.6°120.0°
N09S13N12103.5°102.2°
N09S13O15111.7°107.2°
S13N09C10108.0°104.2°
N12S13O15112.9°107.3°
S13N12C11109.0°107.4°
S13N12H3125.5°126.3°
N09C10C11109.0°111.3°
N09C10H1109.6°109.2°
N09C10H2109.6°109.1°
C23C22H5107.0°109.7°
C22C23H9107.0°109.5°
C23C22H12107.0°109.7°
C22C23H14107.0°109.5°
N12C11C10110.4°114.8°
N12C11O16126.4°122.6°
C11N12H3125.5°126.3°
C10C11O16123.2°122.6°
C11C10H1109.6°109.1°
C11C10H2109.6°109.1°
H1C10H2109.5°109.1°
H5C22H12109.4°109.8°
H6C24H13109.5°109.4°
H9C23H14109.5°109.6°
H10C25H15109.5°109.6°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
N20C21C17H4180.0°180.0°
C21N20N19C25179.9°179.9°
C21N20N19C180.5°0.0°
N20C21C17C02178.8°180.0°
N20C21C17C180.6°0.3°
N19N20C21C170.1°0.2°
N20N19C25C18179.4°179.9°
N20N19C18C170.8°0.2°
N20N19C25C24179.8°162.9°
N20N19C18C22179.8°179.7°
N19N20C21H4179.8°179.8°
N20N19C25H1058.2°43.0°
N20N19C25H1558.7°77.3°
C21C17C02C0334.0°50.4°
C21C17C18N190.9°0.3°
C21C17C02C18177.8°179.7°
C21C17C02C01145.8°129.7°
C21C17C18C22179.9°179.6°
O08C04C03C05179.8°179.9°
O08C04C03C02179.8°179.9°
O08C04C05N090.4°0.0°
O08C04C05C06179.9°179.9°
O08C04C03H80.2°0.1°
C04C03C02H8180.0°180.0°
C04C03C02C17179.6°180.0°
C04C03C02C010.6°0.1°
C03C04C05N09179.8°179.9°
C03C04C05C060.0°0.0°
C03C04O08H11180.0°90.1°
C03C02C17C01179.8°179.9°
C03C02C17C18143.9°130.0°
C02C03C04C050.3°0.1°
C03C02C01C060.6°0.1°
C03C02C01H7179.5°179.7°
C25N19C18C17179.6°179.9°
N19C25C24H10121.6°119.9°
N19C25C24H15121.6°119.9°
C25N19C18C220.3°0.2°
N19C25C24C230.5°50.6°
N19C25C24H6121.8°69.5°
N19C25H10H15114.9°120.4°
N19C25C24H13120.8°170.6°
N19C18C17C02179.1°180.0°
N19C18C17C22179.2°179.9°
C18N19C25C240.3°17.2°
N19C18C22C230.4°15.8°
N19C18C22H5120.9°103.9°
C18N19C25H10121.2°137.1°
N19C18C22H12121.8°135.4°
C18N19C25H15121.9°102.6°
C02C17C18C221.7°0.1°
C17C02C01C06179.7°180.0°
C02C17C21H41.2°0.0°
C17C02C01H70.3°0.3°
C17C02C03H80.4°0.0°
C18C17C02C0136.4°50.0°
C17C18C22C23179.6°164.2°
C18C17C21H4179.4°179.7°
C17C18C22H558.2°76.2°
C17C18C22H1259.0°44.5°
C25C24C23H6121.3°120.0°
C25C24C23H13121.3°120.1°
C25C24C23C220.6°69.4°
C25C24H6H13115.8°120.0°
C25C24C23H9120.7°170.8°
C24C25H10H15114.9°120.3°
C25C24C23H14122.0°50.5°
C04C05N09C06179.7°180.0°
C04C05C06C010.0°0.0°
C04C05N09S1393.5°90.0°
C04C05N09C1080.7°90.0°
C04C05C06F07179.7°179.7°
C05C04C03H8179.7°180.0°
C05C04O08H110.1°90.0°
O14S13N09C0565.9°67.5°
O14S13N09N12112.7°112.4°
O14S13N09O15125.5°134.9°
O14S13N12O15128.9°134.9°
O14S13N09C10109.0°112.5°
O14S13N12C11106.9°112.5°
O14S13N12H373.1°67.5°
C02C01C06C050.3°0.0°
C02C01C06H7180.0°179.7°
C02C01C06F07179.4°179.7°
C01C02C03H8179.4°180.0°
C18C22C23C240.6°48.5°
C18C22C23H5121.4°119.7°
C18C22C23H12121.4°119.7°
C18C22H5H12115.6°120.7°
C18C22C23H9120.7°168.4°
C18C22C23H14122.0°71.3°
C24C23C22H9121.3°119.9°
C24C23C22H14121.3°119.9°
C24C23C22H5120.8°71.2°
C23C24H6H13115.8°119.9°
C24C23H9H14115.7°120.2°
C23C24C25H10121.1°170.4°
C24C23C22H12122.0°168.2°
C23C24C25H15122.1°69.3°
N09C05C06C01179.7°179.9°
C05N09S13C10174.9°180.0°
C05N09S13N12178.6°179.9°
C05N09S13O1559.6°67.4°
N09C05C06F070.1°0.3°
C05N09C10C11177.9°180.0°
C05N09C10H158.0°59.6°
C05N09C10H262.2°59.6°
C05C06C01F07179.6°179.7°
C06C05N09S1386.7°90.0°
C06C05N09C1099.1°90.0°
C05C06C01H7179.8°179.7°
N09S13N12O15120.9°112.6°
N09S13N12C113.3°0.1°
S13N09C10C112.7°0.0°
S13N09C10H1117.2°120.5°
S13N09C10H2122.6°120.4°
N09S13N12H3176.7°180.0°
N12S13N09C103.7°0.0°
S13N12C11H3180.0°180.0°
S13N12C11C101.9°0.1°
S13N12C11O16179.6°180.0°
O15S13N09C10125.4°112.6°
O15S13N12C11124.3°112.5°
O15S13N12H355.8°67.4°
N09C10C11N120.6°0.0°
N09C10C11H1119.9°120.5°
N09C10C11H2119.9°120.4°
N09C10C11O16177.2°180.0°
N09C10H1H2120.2°119.1°
C23C22H5H12115.6°120.6°
C22C23C24H6121.9°50.6°
C22C23H9H14115.6°120.1°
C22C23C24H13120.7°170.6°
F07C06C01H70.6°0.0°
N12C11C10O16177.8°180.0°
N12C11C10H1119.3°120.6°
N12C11C10H2120.5°120.4°
C11C10H1H2120.2°119.1°
C10C11N12H3178.1°180.0°
O16C11C10H162.9°59.5°
O16C11C10H257.3°59.6°
O16C11N12H30.5°0.0°
H5C22C23H9117.9°48.7°
H5C22C23H140.6°169.0°
H6C24C23H90.6°69.2°
H6C24C25H100.2°50.4°
H6C24C23H14116.7°170.5°
H6C24C25H15116.6°170.7°
H9C23C22H120.7°71.9°
H9C23C24H13118.0°50.7°
H10C25C24H13117.6°69.5°
H12C22C23H14116.6°48.3°
H13C24C23H140.7°69.6°
H13C24C25H150.8°50.7°

250835

PDB entries from 2026-03-18

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