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A1AS8

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
CL1C17sing1.74Å1.77Å
C19C17doub1.38Å1.41ÅAromatic
C19C20sing1.38Å1.39ÅAromatic
C17C15sing1.39Å1.41ÅAromatic
C20C13doub1.39Å1.41ÅAromatic
C15F16sing1.35Å1.35Å
C15C14doub1.38Å1.40ÅAromatic
C13C14sing1.39Å1.41ÅAromatic
C13N12sing1.40Å1.48Å
N12C10sing1.35Å1.48Å
C10O11doub1.21Å1.17Å
C10C09sing1.51Å1.60Å
C09C21sing1.53Å1.47Å
C09C08sing1.53Å1.57Å
C21C22sing1.53Å1.45Å
C08N07sing1.47Å1.50Å
C22C23sing1.53Å1.53Å
N07C23sing1.47Å1.49Å
N07C06sing1.35Å1.52Å
C25C26sing1.53Å1.55Å
C25N05sing1.47Å1.45Å
C26N02sing1.47Å1.42Å
C06N05sing1.35Å1.53Å
C06O24doub1.22Å1.23Å
N05C04sing1.47Å1.41Å
N02C01sing1.47Å1.28Å
N02C03sing1.47Å1.40Å
C01CDsing1.53Å1.56Å
C04C03sing1.53Å1.54Å
CDNEsing1.46Å1.51Å
NH2CZdoub1.30Å1.25Å
NECZsing1.38Å1.55Å
CZNH1sing1.37Å1.26Å
CDH1sing1.09Å1.10Å
CDH2sing1.09Å1.10Å
NEH3sing0.97Å1.00Å
NH1H4sing0.97Å1.00Å
NH1H5sing0.97Å1.00Å
NH2H6sing0.97Å1.00Å
C01H7sing1.09Å1.10Å
C01H8sing1.09Å1.10Å
C03H9sing1.09Å1.10Å
C03H10sing1.09Å1.10Å
C04H11sing1.09Å1.10Å
C04H12sing1.09Å1.10Å
C08H13sing1.09Å1.10Å
C08H14sing1.09Å1.10Å
C09H15sing1.09Å1.10Å
C14H16sing1.08Å1.08Å
C19H17sing1.08Å1.08Å
C20H18sing1.08Å1.08Å
C21H19sing1.09Å1.10Å
C21H20sing1.09Å1.10Å
C22H21sing1.09Å1.10Å
C22H22sing1.09Å1.10Å
C23H23sing1.09Å1.10Å
C23H24sing1.09Å1.10Å
C25H25sing1.09Å1.10Å
C25H26sing1.09Å1.10Å
C26H27sing1.09Å1.10Å
C26H28sing1.09Å1.10Å
N12H30sing0.97Å1.00Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
CL1C17C19120.7°119.9°
CL1C17C15119.6°120.0°
C17C19C20119.9°120.0°
C19C17C15119.7°120.1°
C17C19H17120.1°120.0°
C19C20C13120.8°120.0°
C20C19H17120.0°120.0°
C19C20H18119.6°120.0°
C17C15F16118.6°120.0°
C17C15C14120.4°120.0°
C20C13C14119.2°119.9°
C20C13N12117.7°120.1°
C13C20H18119.6°120.0°
F16C15C14121.0°120.0°
C15C14C13119.9°119.9°
C15C14H16120.0°120.0°
C14C13N12123.1°120.0°
C13C14H16120.0°120.1°
C13N12C10124.1°120.0°
C13N12H30117.9°120.0°
N12C10O11121.3°120.0°
N12C10C09120.5°120.0°
C10N12H30118.0°120.0°
O11C10C09118.1°120.0°
C10C09C21103.0°109.5°
C10C09C08111.2°109.5°
C10C09H15107.8°109.5°
C21C09C08116.9°109.3°
C09C21C22104.2°109.5°
C21C09H15109.4°109.6°
C09C21H19110.8°109.4°
C09C21H20110.8°109.5°
C09C08N07119.6°108.8°
C09C08H13106.9°109.6°
C09C08H14106.9°109.7°
C08C09H15108.1°109.4°
C21C22C23106.9°109.3°
C22C21H19110.8°109.5°
C22C21H20110.8°109.5°
C21C22H21110.1°109.5°
C21C22H22110.1°109.5°
C08N07C23111.5°118.7°
C08N07C06128.4°120.7°
N07C08H13106.9°109.6°
N07C08H14106.9°109.6°
C22C23N07106.2°108.8°
C23C22H21110.1°109.5°
C23C22H22110.1°109.5°
C22C23H23110.3°109.6°
C22C23H24110.3°109.6°
C23N07C06120.1°120.6°
N07C23H23110.3°109.6°
N07C23H24110.3°109.7°
N07C06N05129.5°120.0°
N07C06O24114.6°119.9°
C26C25N05117.9°108.5°
C25C26N02112.5°109.3°
C26C25H25107.3°109.6°
C26C25H26107.3°109.6°
C25C26H27108.7°109.5°
C25C26H28108.7°109.5°
C25N05C06132.6°120.8°
C25N05C04111.0°118.3°
N05C25H25107.3°109.6°
N05C25H26107.3°109.7°
C26N02C01116.7°111.0°
C26N02C03114.3°111.2°
N02C26H27108.7°109.5°
N02C26H28108.7°109.5°
N05C06O24115.9°120.1°
C06N05C04116.3°120.9°
N05C04C03115.0°108.5°
N05C04H11108.1°109.6°
N05C04H12108.1°109.7°
C01N02C03110.5°111.0°
N02C01CD115.2°109.5°
N02C01H7108.1°109.5°
N02C01H8108.1°109.5°
N02C03C04118.4°109.4°
N02C03H9107.2°109.5°
N02C03H10107.2°109.5°
C01CDNE112.0°109.5°
C01CDH1108.8°109.5°
C01CDH2108.8°109.5°
CDC01H7108.0°109.5°
CDC01H8108.0°109.5°
C04C03H9107.2°109.5°
C04C03H10107.2°109.5°
C03C04H11108.1°109.7°
C03C04H12108.1°109.7°
CDNECZ120.7°120.0°
NECDH1108.8°109.5°
NECDH2108.8°109.5°
CDNEH3119.6°120.0°
NH2CZNE119.1°120.0°
NH2CZNH1118.7°120.0°
CZNH2H6112.0°120.0°
NECZNH1122.1°120.0°
CZNEH3119.6°120.0°
CZNH1H4120.0°120.1°
CZNH1H5120.0°120.0°
H1CDH2109.5°109.4°
H4NH1H5120.0°120.0°
H7C01H8109.5°109.4°
H9C03H10109.4°109.5°
H11C04H12109.5°109.7°
H13C08H14109.5°109.6°
H19C21H20109.5°109.5°
H21C22H22109.4°109.5°
H23C23H24109.5°109.6°
H25C25H26109.5°109.8°
H27C26H28109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
CL1C17C19C15179.9°180.0°
CL1C17C19C20180.0°179.7°
CL1C17C15F160.1°0.0°
CL1C17C15C14180.0°180.0°
CL1C17C19H170.0°0.0°
C17C19C20H17180.0°179.7°
C17C19C20C130.0°0.6°
C19C17C15F16179.9°180.0°
C19C17C15C140.1°0.0°
C17C19C20H18180.0°180.0°
C20C19C17C150.1°0.3°
C19C20C13H18180.0°179.4°
C19C20C13C140.1°0.6°
C19C20C13N12180.0°179.7°
C17C15F16C14180.0°179.9°
C17C15C14C130.0°0.1°
C17C15C14H16179.9°180.0°
C15C17C19H17179.9°180.0°
C20C13C14C150.1°0.2°
C20C13C14N12180.0°179.8°
C20C13N12C10165.2°144.5°
C20C13C14H16180.0°179.7°
C13C20C19H17180.0°179.7°
C20C13N12H3014.8°35.5°
F16C15C14C13179.9°180.0°
F16C15C14H160.1°0.0°
C15C14C13H16180.0°179.9°
C15C14C13N12180.0°180.0°
C14C13N12C1014.7°35.8°
C14C13C20H18179.9°179.9°
C14C13N12H30165.3°144.3°
C13N12C10H30180.0°180.0°
C13N12C10O111.7°4.6°
C13N12C10C09179.9°175.2°
N12C13C14H160.0°0.1°
N12C13C20H180.0°0.3°
N12C10O11C09178.4°179.8°
N12C10C09C21102.4°179.7°
N12C10C09C08131.6°59.9°
N12C10C09H1513.2°60.1°
O11C10C09C2176.0°0.1°
O11C10C09C0850.0°119.9°
O11C10C09H15168.4°120.1°
O11C10N12H30178.3°175.4°
C10C09C21C08122.2°119.9°
C10C09C21H15114.5°120.2°
C10C09C08H15118.2°120.1°
C10C09C21C22163.5°178.7°
C10C09C08N07133.4°174.6°
C10C09C08H1312.0°54.8°
C10C09C08H14105.2°65.5°
C10C09C21H1977.3°58.7°
C10C09C21H2044.4°61.3°
C09C10N12H300.0°4.8°
C21C09C08H15124.0°120.0°
C09C21C22H19119.2°120.0°
C09C21C22H20119.1°120.0°
C21C09C08N0715.6°54.6°
C09C21C22C2374.0°61.4°
C21C09C08H13105.9°65.1°
C21C09C08H14137.0°174.5°
C09C21H19H20122.4°120.0°
C09C21C22H2145.6°58.6°
C09C21C22H22166.4°178.6°
C08C09C21C2241.3°61.4°
C09C08N07H13121.4°119.8°
C09C08N07H14121.4°120.0°
C09C08N07C2318.6°53.6°
C09C08N07C06161.2°126.3°
C09C08H13H14115.4°120.4°
C08C09C21H19160.5°178.6°
C08C09C21H2077.9°58.7°
C21C22C23H21119.6°119.9°
C21C22C23H22119.6°120.0°
C21C22C23N0780.4°54.6°
C22C21C09H1582.0°58.6°
C22C21H19H20122.5°120.0°
C21C22H21H22121.1°120.1°
C21C22C23H23160.1°174.4°
C21C22C23H2439.1°65.3°
C08N07C23C2247.0°53.6°
C08N07C23C06179.8°179.9°
C08N07C06N050.0°163.6°
C08N07C06O24179.3°16.3°
N07C08H13H14115.4°120.3°
N07C08C09H15108.4°65.4°
C08N07C23H23166.5°173.3°
C08N07C23H2472.5°66.3°
C22C23N07H23119.5°119.8°
C22C23N07H24119.5°119.8°
C22C23N07C06132.8°126.4°
C23C22C21H19166.8°178.6°
C23C22C21H2045.2°58.6°
C23C22H21H22121.2°120.1°
C22C23H23H24121.5°120.3°
C23N07C06N05179.8°16.4°
C23N07C06O241.0°163.6°
C23N07C08H13102.8°66.2°
C23N07C08H14140.0°173.6°
N07C23C22H2139.2°65.3°
N07C23C22H22160.0°174.6°
N07C23H23H24121.5°120.5°
N07C06N05C253.5°164.2°
N07C06N05O24179.2°180.0°
N07C06N05C04179.1°15.8°
C06N07C08H1377.4°113.9°
C06N07C08H1439.7°6.4°
C06N07C23H2313.3°6.6°
C06N07C23H24107.7°113.8°
C26C25N05H25121.2°119.7°
C26C25N05H26121.2°119.7°
C25C26N02H27120.5°120.0°
C25C26N02H28120.4°119.9°
C26C25N05C06135.6°128.8°
C26C25N05C0448.6°51.1°
C25C26N02C01123.2°172.8°
C25C26N02C037.8°63.2°
C26C25H25H26116.2°120.5°
C25C26H27H28118.6°120.0°
N05C25C26N0241.1°53.8°
C25N05C06C04175.6°179.9°
C25N05C06O24177.2°15.8°
C25N05C04C039.9°51.1°
C25N05C04H11110.9°170.9°
C25N05C04H12130.7°68.7°
N05C25H25H26116.1°120.5°
N05C25C26H2779.4°66.2°
N05C25C26H28161.5°173.8°
C26N02C01C03132.8°124.2°
C26N02C01CD117.7°170.0°
C26N02C03C0446.7°63.2°
C26N02C01H7121.5°50.0°
C26N02C01H83.1°69.9°
C26N02C03H9168.0°176.9°
C26N02C03H1074.6°56.8°
N02C26C25H2580.2°65.8°
N02C26C25H26162.3°173.6°
N02C26H27H28118.7°120.1°
C06N05C04C03173.6°128.8°
C06N05C04H1165.6°9.1°
C06N05C04H1252.8°111.4°
C06N05C25H25103.2°111.5°
C06N05C25H2614.4°9.1°
O24C06N05C041.6°164.2°
N05C04C03N0238.4°53.8°
N05C04C03H11120.8°119.7°
N05C04C03H12120.8°119.8°
N05C04C03H9159.7°173.8°
N05C04C03H1082.9°66.2°
N05C04H11H12117.5°120.5°
C04N05C25H2572.6°68.5°
C04N05C25H26169.9°170.9°
N02C01CDH7120.9°120.0°
N02C01CDH8120.8°120.1°
C01N02C03C0487.3°172.7°
N02C01CDNE102.1°180.0°
N02C01CDH1137.5°60.0°
N02C01CDH218.3°60.0°
N02C01H7H8117.5°120.0°
C01N02C03H934.0°52.8°
C01N02C03H10151.4°67.3°
C01N02C26H272.7°67.2°
C01N02C26H28116.4°52.8°
C03N02C01CD109.6°65.7°
N02C03C04H9121.3°119.9°
N02C03C04H10121.3°120.0°
C03N02C01H711.3°174.3°
C03N02C01H8129.6°54.3°
N02C03H9H10116.0°120.1°
N02C03C04H11159.2°173.5°
N02C03C04H1282.4°66.0°
C03N02C26H27128.3°56.8°
C03N02C26H28112.6°176.9°
C01CDNEH1120.4°120.1°
C01CDNEH2120.4°120.0°
C01CDNECZ175.7°180.0°
C01CDH1H2118.8°120.0°
C01CDNEH34.2°0.0°
CDC01H7H8117.4°120.0°
C04C03H9H10116.0°120.0°
C03C04H11H12117.5°120.5°
CDNECZNH20.6°180.0°
CDNECZH3180.0°179.9°
CDNECZNH1179.2°0.0°
NECDH1H2118.9°120.0°
NECDC01H718.7°60.0°
NECDC01H8137.0°60.0°
NH2CZNENH1178.6°180.0°
NH2CZNEH3179.4°0.1°
NH2CZNH1H4178.6°180.0°
NH2CZNH1H51.4°0.1°
CZNECDH163.9°60.0°
CZNECDH255.4°60.0°
NECZNH1H40.0°0.1°
NECZNH1H5180.0°180.0°
NECZNH2H6178.6°179.9°
NH1CZNEH30.8°180.0°
CZNH1H4H5180.0°179.9°
NH1CZNH2H60.0°0.0°
H1CDNEH3116.1°120.1°
H1CDC01H7101.6°180.0°
H1CDC01H816.7°60.1°
H2CDNEH3124.6°120.0°
H2CDC01H7139.1°60.1°
H2CDC01H8102.6°180.0°
H9C03C04H1179.5°66.5°
H9C03C04H1238.9°53.9°
H10C03C04H1137.9°53.5°
H10C03C04H12156.3°174.0°
H13C08C09H15130.2°174.9°
H14C08C09H1513.0°54.5°
H15C09C21H1937.1°61.4°
H15C09C21H20158.8°178.6°
H17C19C20H180.0°0.3°
H19C21C22H2173.5°61.4°
H19C21C22H2247.2°58.6°
H20C21C22H21164.8°178.6°
H20C21C22H2274.5°61.4°
H21C22C23H2380.3°54.4°
H21C22C23H24158.7°174.8°
H22C22C23H2340.5°65.6°
H22C22C23H2480.5°54.7°
H25C25C26H27159.4°174.2°
H25C25C26H2840.3°54.1°
H26C25C26H2741.8°53.6°
H26C25C26H2877.3°66.5°

250359

PDB entries from 2026-03-11

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