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HBG

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C18C17sing1.53Å1.52Å
C18C19sing1.53Å1.56Å
C17C16sing1.53Å1.50Å
C19C20sing1.53Å1.56Å
C16C15sing1.53Å1.53Å
C20C15sing1.53Å1.56Å
C15N14sing1.47Å1.47Å
C01C02sing1.51Å1.52Å
N14C12sing1.35Å1.40Å
C02C32doub1.38Å1.40ÅAromatic
C02C03sing1.38Å1.40ÅAromatic
C12O13doub1.21Å1.22Å
C12C11sing1.51Å1.56Å
C32C07sing1.40Å1.41ÅAromatic
C21N10sing1.47Å1.48Å
C21C22sing1.51Å1.52Å
C31C22doub1.38Å1.40ÅAromatic
C31C30sing1.38Å1.39ÅAromatic
N10C11sing1.46Å1.49Å
N10C08sing1.35Å1.45Å
C22C23sing1.38Å1.40ÅAromatic
C30C25doub1.40Å1.39ÅAromatic
C03C04doub1.38Å1.41ÅAromatic
C07C08sing1.48Å1.54Å
C07C06doub1.40Å1.41ÅAromatic
C08O09doub1.22Å1.22Å
C23C24doub1.38Å1.40ÅAromatic
C25C24sing1.40Å1.42ÅAromatic
C25C26sing1.48Å1.51Å
C06C04sing1.38Å1.40ÅAromatic
C04C05sing1.51Å1.50Å
O27C26doub1.22Å1.22Å
C26N28sing1.35Å1.42Å
N28O29sing1.42Å1.36Å
C01H1sing1.09Å1.10Å
C01H2sing1.09Å1.10Å
C01H3sing1.09Å1.10Å
C03H4sing1.08Å1.08Å
C05H5sing1.09Å1.10Å
C05H6sing1.09Å1.10Å
C05H7sing1.09Å1.10Å
C06H8sing1.08Å1.08Å
C11H9sing1.09Å1.10Å
C11H10sing1.09Å1.10Å
C15H11sing1.09Å1.10Å
C16H12sing1.09Å1.10Å
C16H13sing1.09Å1.10Å
C17H14sing1.09Å1.10Å
C17H15sing1.09Å1.10Å
C18H16sing1.09Å1.10Å
C18H17sing1.09Å1.10Å
C19H18sing1.09Å1.10Å
C19H19sing1.09Å1.10Å
C20H20sing1.09Å1.10Å
C20H21sing1.09Å1.10Å
C21H22sing1.09Å1.10Å
C21H23sing1.09Å1.10Å
C23H24sing1.08Å1.08Å
C24H25sing1.08Å1.08Å
C30H26sing1.08Å1.08Å
C31H27sing1.08Å1.08Å
C32H28sing1.08Å1.08Å
N14H29sing0.97Å1.00Å
N28H30sing0.97Å1.00Å
O29H31sing0.97Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C17C18C19114.8°109.5°
C18C17C16111.8°109.4°
C18C17H14108.9°109.5°
C18C17H15108.9°109.5°
C17C18H16108.1°109.5°
C17C18H17108.1°109.4°
C18C19C20117.5°109.5°
C19C18H16108.1°109.5°
C19C18H17108.1°109.5°
C18C19H18107.4°109.5°
C18C19H19107.5°109.5°
C17C16C15112.0°109.5°
C17C16H12108.9°109.5°
C17C16H13108.8°109.4°
C16C17H14108.9°109.5°
C16C17H15108.9°109.5°
C19C20C15117.0°109.5°
C20C19H18107.4°109.5°
C20C19H19107.4°109.5°
C19C20H20107.5°109.5°
C19C20H21107.5°109.5°
C16C15C20107.9°109.5°
C16C15N14112.4°109.5°
C16C15H11108.3°109.5°
C15C16H12108.9°109.5°
C15C16H13108.9°109.5°
C20C15N14111.4°109.5°
C20C15H11107.8°109.5°
C15C20H20107.6°109.5°
C15C20H21107.6°109.5°
C15N14C12128.4°120.0°
N14C15H11108.9°109.4°
C15N14H29115.8°120.0°
C01C02C32121.1°119.9°
C01C02C03121.7°119.9°
C02C01H1109.5°109.5°
C02C01H2109.4°109.5°
C02C01H3109.5°109.4°
N14C12O13120.1°119.9°
N14C12C11121.5°120.0°
C12N14H29115.8°119.9°
C32C02C03117.2°120.1°
C02C32C07123.5°119.9°
C02C32H28118.3°120.0°
C02C03C04122.3°120.3°
C02C03H4118.8°119.9°
O13C12C11118.4°120.0°
C12C11N10120.7°109.5°
C12C11H9106.6°109.4°
C12C11H10106.6°109.5°
C32C07C08123.2°120.2°
C32C07C06116.5°119.7°
C07C32H28118.2°120.1°
N10C21C22116.8°109.4°
C21N10C11121.2°120.0°
C21N10C08117.2°120.0°
N10C21H22107.6°109.5°
N10C21H23107.6°109.5°
C21C22C31123.2°119.9°
C21C22C23121.4°119.9°
C22C21H22107.6°109.5°
C22C21H23107.6°109.5°
C22C31C30122.0°120.1°
C31C22C23115.3°120.2°
C22C31H27119.0°119.9°
C31C30C25123.5°119.9°
C31C30H26118.2°120.0°
C30C31H27119.0°120.0°
C11N10C08121.7°120.0°
N10C11H9106.6°109.5°
N10C11H10106.6°109.5°
N10C08C07124.0°120.0°
N10C08O09116.1°120.0°
C22C23C24122.6°120.2°
C22C23H24118.7°119.8°
C30C25C24114.4°119.7°
C30C25C26125.1°120.2°
C25C30H26118.2°120.1°
C03C04C06118.1°120.2°
C03C04C05120.7°119.9°
C04C03H4118.9°119.8°
C08C07C06120.3°120.1°
C07C08O09119.9°120.0°
C07C06C04122.4°119.8°
C07C06H8118.8°120.1°
C23C24C25122.1°119.9°
C24C23H24118.7°120.0°
C23C24H25119.0°120.1°
C24C25C26120.5°120.2°
C25C24H25118.9°120.1°
C25C26O27121.3°120.0°
C25C26N28120.7°120.0°
C06C04C05121.2°119.9°
C04C06H8118.8°120.1°
C04C05H5109.5°109.5°
C04C05H6109.5°109.4°
C04C05H7109.5°109.4°
O27C26N28118.0°120.0°
C26N28O29120.0°120.0°
C26N28H30120.0°120.0°
O29N28H30120.0°120.0°
N28O29H31109.5°114.0°
H1C01H2109.5°109.4°
H1C01H3109.4°109.5°
H2C01H3109.5°109.5°
H5C05H6109.5°109.5°
H5C05H7109.4°109.5°
H6C05H7109.5°109.5°
H9C11H10109.5°109.5°
H12C16H13109.5°109.5°
H14C17H15109.5°109.5°
H16C18H17109.5°109.5°
H18C19H19109.5°109.4°
H20C20H21109.5°109.5°
H22C21H23109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C17C18C19H16120.8°120.0°
C17C18C19H17120.8°120.0°
C18C17C16H14120.4°120.0°
C18C17C16H15120.3°120.0°
C17C18C19C2024.3°60.0°
C18C17C16C1565.2°60.0°
C18C17C16H12174.4°60.0°
C18C17C16H1355.2°180.0°
C18C17H14H15118.9°120.0°
C17C18H16H17117.6°120.0°
C17C18C19H18145.5°180.0°
C17C18C19H1996.8°60.0°
C19C18C17C1643.3°60.0°
C18C19C20H18121.1°120.0°
C18C19C20H19121.2°120.0°
C18C19C20C1524.9°60.0°
C19C18C17H1477.1°180.0°
C19C18C17H15163.6°60.0°
C19C18H16H17117.6°120.0°
C18C19H18H19116.4°120.0°
C18C19C20H2096.2°180.0°
C18C19C20H21146.0°60.0°
C17C16C15H12120.4°120.0°
C17C16C15H13120.4°120.0°
C17C16C15C2062.8°60.0°
C17C16C15N14174.0°180.0°
C17C16C15H1153.6°60.0°
C17C16H12H13118.8°120.0°
C16C17H14H15118.9°120.0°
C16C17C18H1677.5°60.0°
C16C17C18H17164.0°180.0°
C19C20C15C1642.3°60.0°
C19C20C15H20121.1°120.0°
C19C20C15H21121.1°120.0°
C19C20C15N14166.1°180.0°
C19C20C15H1174.4°60.0°
C20C19C18H1696.4°60.0°
C20C19C18H17145.1°180.0°
C20C19H18H19116.4°120.0°
C19C20H20H21116.5°120.0°
C16C15C20N14123.8°120.0°
C16C15C20H11116.7°120.0°
C16C15N14H11120.0°120.0°
C16C15N14C12105.5°155.0°
C15C16H12H13118.9°120.0°
C15C16C17H1455.2°180.0°
C15C16C17H15174.5°60.0°
C16C15C20H2078.8°180.0°
C16C15C20H21163.4°60.0°
C16C15N14H2974.5°25.0°
C20C15N14H11118.8°120.0°
C20C15N14C12133.2°85.0°
C20C15C16H12176.8°60.0°
C20C15C16H1357.6°180.0°
C15C20C19H18146.1°180.0°
C15C20C19H1996.2°60.0°
C15C20H20H21116.6°120.0°
C20C15N14H2946.8°95.0°
C15N14C12H29180.0°180.0°
C15N14C12O130.4°0.0°
C15N14C12C11179.3°180.0°
N14C15C16H1253.6°60.0°
N14C15C16H1365.6°60.0°
N14C15C20H2045.0°60.0°
N14C15C20H2172.8°60.0°
C01C02C32C03179.8°179.7°
C01C02C32C07180.0°179.8°
C01C02C03C04180.0°180.0°
C02C01H1H2120.0°120.0°
C02C01H1H3120.0°120.0°
C02C01H2H3120.0°120.0°
C01C02C03H40.0°0.0°
C01C02C32H280.0°0.0°
N14C12O13C11179.7°180.0°
N14C12C11N1018.8°180.0°
N14C12C11H9140.4°60.0°
N14C12C11H10102.7°59.9°
C12N14C15H1114.4°35.0°
C02C32C07H28180.0°179.8°
C32C02C03C040.2°0.3°
C02C32C07C08179.7°179.8°
C02C32C07C060.1°0.5°
C32C02C01H189.9°90.0°
C32C02C01H2150.1°150.0°
C32C02C01H330.1°30.0°
C32C02C03H4179.8°179.7°
C03C02C32C070.2°0.5°
C02C03C04H4180.0°180.0°
C02C03C04C060.2°0.0°
C02C03C04C05179.9°180.0°
C03C02C01H189.9°89.7°
C03C02C01H230.1°30.3°
C03C02C01H3150.1°150.3°
C03C02C32H28179.8°179.7°
O13C12C11N10160.8°0.0°
O13C12C11H939.3°120.0°
O13C12C11H1077.6°120.0°
O13C12N14H29179.6°180.0°
C12C11N10C21109.5°82.2°
C12C11N10H9121.5°120.0°
C12C11N10H10121.6°120.0°
C12C11N10C0870.2°97.8°
C12C11H9H10115.0°120.0°
C11C12N14H290.7°0.1°
C32C07C08N1067.6°47.6°
C32C07C08C06179.8°179.7°
C32C07C08O09113.4°132.4°
C32C07C06C040.0°0.3°
C32C07C06H8180.0°179.8°
N10C21C22H22121.1°120.0°
N10C21C22H23121.1°120.0°
N10C21C22C31167.3°90.3°
C21N10C11C08179.8°180.0°
N10C21C22C2312.5°90.0°
C21N10C08C070.4°175.3°
C21N10C08O09179.4°4.6°
C21N10C11H9128.9°37.8°
C21N10C11H1012.0°157.8°
N10C21H22H23116.7°120.0°
C21C22C31C23179.8°179.6°
C21C22C31C30179.6°179.8°
C22C21N10C1173.4°90.0°
C22C21N10C08106.8°90.0°
C21C22C23C24179.7°180.0°
C22C21H22H23116.6°120.1°
C21C22C23H240.3°0.1°
C21C22C31H270.3°0.0°
C22C31C30H27180.0°179.8°
C22C31C30C250.1°0.5°
C31C22C23C240.2°0.3°
C31C22C21H2246.2°29.7°
C31C22C21H2371.6°149.7°
C31C22C23H24179.8°179.7°
C22C31C30H26179.9°179.7°
C30C31C22C230.2°0.6°
C31C30C25H26180.0°179.8°
C31C30C25C240.1°0.2°
C31C30C25C26179.9°179.7°
C11N10C08C07179.8°4.6°
C11N10C08O090.8°175.4°
N10C11H9H10114.9°120.0°
C11N10C21H2247.6°30.0°
C11N10C21H23165.5°150.0°
N10C08C07O09179.0°180.0°
N10C08C07C06112.2°132.7°
C08N10C11H951.3°142.2°
C08N10C11H10168.2°22.2°
C08N10C21H22132.1°150.0°
C08N10C21H2314.3°30.0°
C22C23C24H24180.0°180.0°
C22C23C24C250.0°0.0°
C23C22C21H22133.6°150.0°
C23C22C21H23108.6°29.9°
C22C23C24H25179.9°179.9°
C23C22C31H27179.8°179.6°
C30C25C24C230.1°0.1°
C30C25C24C26179.8°179.9°
C30C25C26O2711.5°180.0°
C30C25C26N28168.7°0.1°
C30C25C24H25179.9°180.0°
C25C30C31H27179.9°179.7°
C03C04C06C070.0°0.0°
C03C04C06C05179.7°180.0°
C03C04C05H589.9°90.0°
C03C04C05H6150.1°150.0°
C03C04C05H730.1°30.0°
C03C04C06H8180.0°179.9°
C08C07C06C04179.8°180.0°
C08C07C06H80.2°0.1°
C08C07C32H280.3°0.0°
C06C07C08O0966.8°47.3°
C07C06C04H8180.0°179.9°
C07C06C04C05179.8°180.0°
C06C07C32H28180.0°179.7°
C23C24C25H25180.0°179.9°
C23C24C25C26179.9°180.0°
C24C25C26O27168.3°0.1°
C24C25C26N2811.5°180.0°
C25C24C23H24179.9°180.0°
C24C25C30H26179.9°180.0°
C25C26O27N28179.8°180.0°
C25C26N28O29180.0°180.0°
C26C25C24H250.1°0.1°
C26C25C30H260.1°0.1°
C25C26N28H300.0°0.0°
C06C04C03H4179.8°179.9°
C06C04C05H589.9°90.0°
C06C04C05H630.1°30.0°
C06C04C05H7150.1°150.0°
C05C04C03H40.1°0.1°
C04C05H5H6120.0°120.0°
C04C05H5H7120.0°120.0°
C04C05H6H7120.0°120.0°
C05C04C06H80.2°0.1°
O27C26N28O290.2°0.0°
O27C26N28H30179.8°180.0°
C26N28O29H30180.0°180.0°
C26N28O29H310.1°180.0°
H1C01H2H3120.0°120.0°
H5C05H6H7119.9°120.1°
H11C15C16H1266.8°179.9°
H11C15C16H13174.0°59.9°
H11C15C20H20164.5°60.0°
H11C15C20H2146.6°180.0°
H11C15N14H29165.6°145.0°
H12C16C17H1465.2°60.0°
H12C16C17H1554.1°NaN°
H13C16C17H14175.5°60.1°
H13C16C17H1565.1°60.0°
H14C17C18H16162.1°60.0°
H14C17C18H1743.7°60.1°
H15C17C18H1642.8°180.0°
H15C17C18H1775.6°60.0°
H16C18C19H1824.7°60.0°
H16C18C19H19142.4°NaN°
H17C18C19H1893.7°60.0°
H17C18C19H1923.9°60.0°
H18C19C20H2025.0°60.0°
H18C19C20H2192.8°60.0°
H19C19C20H20142.7°60.0°
H19C19C20H2124.9°180.0°
H24C23C24H250.1°0.1°
H26C30C31H270.0°0.1°
H30N28O29H31179.9°0.0°

222624

PDB entries from 2024-07-17

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