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A1L0D

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C10C9sing1.53Å1.51Å
C10C11sing1.53Å1.52Å
C9C8sing1.53Å1.51Å
C8C7sing1.53Å1.52Å
C11C6sing1.53Å1.52Å
C6C7sing1.53Å1.52Å
C6N4sing1.46Å1.48Å
N4N3sing1.40Å1.34ÅAromatic
N4C5sing1.35Å1.36ÅAromatic
N3N2doub1.29Å1.30ÅAromatic
C5C1doub1.37Å1.37ÅAromatic
N2C1sing1.34Å1.37ÅAromatic
C1C2sing1.48Å1.47Å
C2O3doub1.22Å1.23Å
C2N1sing1.35Å1.33Å
N1C3sing1.46Å1.46Å
O2B1sing1.42Å1.36Å
C12C13sing1.53Å1.53Å
C12C4sing1.53Å1.53Å
C3B1sing1.57Å1.58Å
C3C4sing1.53Å1.54Å
O1B1sing1.42Å1.36Å
C13C14sing1.53Å1.52Å
C14C15sing1.53Å1.52Å
C4C16sing1.53Å1.53Å
C16C15sing1.53Å1.53Å
C4H1sing1.09Å1.10Å
C5H2sing1.08Å1.08Å
C6H3sing1.09Å1.10Å
C8H4sing1.09Å1.10Å
C8H5sing1.09Å1.10Å
N1H6sing0.97Å1.00Å
C3H7sing1.09Å1.10Å
O1H8sing0.97Å0.95Å
O2H9sing0.97Å0.95Å
C7H10sing1.09Å1.10Å
C7H11sing1.09Å1.10Å
C9H12sing1.09Å1.10Å
C9H13sing1.09Å1.10Å
C10H14sing1.09Å1.10Å
C10H15sing1.09Å1.10Å
C11H16sing1.09Å1.10Å
C11H17sing1.09Å1.10Å
C12H18sing1.09Å1.10Å
C12H19sing1.09Å1.10Å
C13H20sing1.09Å1.10Å
C13H21sing1.09Å1.10Å
C14H22sing1.09Å1.10Å
C14H23sing1.09Å1.10Å
C15H24sing1.09Å1.10Å
C15H25sing1.09Å1.10Å
C16H26sing1.09Å1.10Å
C16H27sing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C9C10C11111.5°109.4°
C10C9C8110.8°109.5°
C10C9H12109.1°109.4°
C10C9H13109.1°109.5°
C9C10H14109.0°109.5°
C9C10H15109.0°109.5°
C10C11C6110.8°109.4°
C11C10H14108.9°109.5°
C11C10H15109.0°109.4°
C10C11H16109.1°109.5°
C10C11H17109.1°109.4°
C9C8C7111.6°109.5°
C9C8H4109.0°109.5°
C9C8H5108.9°109.5°
C8C9H12109.1°109.4°
C8C9H13109.1°109.5°
C8C7C6111.0°109.5°
C7C8H4108.9°109.4°
C7C8H5108.9°109.5°
C8C7H10109.1°109.5°
C8C7H11109.1°109.5°
C11C6C7111.6°109.5°
C11C6N4111.7°109.4°
C11C6H3107.2°109.5°
C6C11H16109.1°109.5°
C6C11H17109.1°109.5°
C7C6N4111.1°109.5°
C7C6H3107.2°109.4°
C6C7H10109.1°109.5°
C6C7H11109.1°109.4°
C6N4N3119.2°126.6°
C6N4C5129.7°126.6°
N4C6H3107.7°109.5°
N3N4C5111.2°106.8°
N4N3N2106.7°108.4°
N4C5C1104.5°106.9°
N4C5H2127.8°126.6°
N3N2C1110.0°109.5°
C5C1N2107.6°108.5°
C5C1C2129.9°125.8°
C1C5H2127.7°126.6°
N2C1C2122.5°125.8°
C1C2O3120.1°120.0°
C1C2N1116.6°120.0°
O3C2N1122.8°120.0°
C2N1C3122.3°120.0°
C2N1H6118.8°120.0°
N1C3B1115.4°109.4°
N1C3C4109.2°109.5°
C3N1H6118.9°120.0°
N1C3H7107.7°109.4°
O2B1C3109.5°120.0°
O2B1O1109.2°120.0°
B1O2H9109.5°114.0°
C13C12C4112.4°109.5°
C12C13C14111.4°109.5°
C13C12H18108.7°109.4°
C13C12H19108.7°109.5°
C12C13H20109.0°109.5°
C12C13H21109.0°109.5°
C12C4C3110.1°109.5°
C12C4C16109.3°109.5°
C12C4H1109.4°109.5°
C4C12H18108.7°109.5°
C4C12H19108.7°109.5°
B1C3C4111.1°109.5°
C3B1O1109.7°120.0°
B1C3H7106.3°109.5°
C3C4C16109.5°109.4°
C3C4H1109.2°109.4°
C4C3H7106.7°109.5°
B1O1H8109.5°114.0°
C13C14C15110.9°109.4°
C14C13H20109.0°109.5°
C14C13H21109.0°109.5°
C13C14H22109.1°109.5°
C13C14H23109.1°109.4°
C14C15C16111.4°109.5°
C15C14H22109.1°109.5°
C15C14H23109.1°109.5°
C14C15H24109.0°109.5°
C14C15H25109.0°109.5°
C4C16C15112.5°109.4°
C16C4H1109.4°109.5°
C4C16H26108.7°109.5°
C4C16H27108.7°109.4°
C16C15H24109.0°109.4°
C16C15H25109.0°109.5°
C15C16H26108.7°109.5°
C15C16H27108.7°109.5°
H4C8H5109.5°109.5°
H10C7H11109.5°109.5°
H12C9H13109.5°109.4°
H14C10H15109.5°109.5°
H16C11H17109.4°109.5°
H18C12H19109.5°109.5°
H20C13H21109.5°109.5°
H22C14H23109.5°109.5°
H24C15H25109.5°109.5°
H26C16H27109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C9C10C11H14120.3°120.0°
C9C10C11H15120.3°120.0°
C10C9C8H12120.2°120.0°
C10C9C8H13120.2°120.1°
C10C9C8C756.1°60.0°
C9C10C11C655.7°60.0°
C10C9C8H4176.4°59.9°
C10C9C8H564.2°180.0°
C10C9H12H13119.4°120.0°
C9C10H14H15119.1°120.1°
C9C10C11H16175.9°60.0°
C9C10C11H1764.5°180.0°
C11C10C9C856.4°60.1°
C10C11C6H16120.2°120.0°
C10C11C6H17120.2°120.0°
C10C11C6C754.7°60.0°
C10C11C6N4179.8°180.0°
C10C11C6H362.4°60.0°
C11C10C9H1263.8°180.0°
C11C10C9H13176.6°60.0°
C11C10H14H15119.1°120.0°
C10C11H16H17119.4°120.0°
C9C8C7H4120.3°120.0°
C9C8C7H5120.3°120.0°
C9C8C7C655.2°60.0°
C9C8H4H5119.0°120.1°
C9C8C7H1065.1°180.0°
C9C8C7H11175.4°59.9°
C8C9H12H13119.4°120.0°
C8C9C10H1463.9°60.0°
C8C9C10H15176.7°180.0°
C8C7C6C1154.5°60.0°
C8C7C6H10120.2°120.1°
C8C7C6H11120.2°120.0°
C8C7C6N4179.9°180.0°
C8C7C6H362.6°60.0°
C7C8H4H5119.0°120.0°
C8C7H10H11119.3°120.0°
C7C8C9H1264.1°180.0°
C7C8C9H13176.3°60.0°
C11C6C7N4125.4°120.0°
C11C6C7H3117.1°120.0°
C11C6N4H3117.5°120.0°
C11C6N4N3128.1°145.0°
C11C6N4C552.9°34.6°
C11C6C7H1065.8°180.0°
C11C6C7H11174.7°60.0°
C6C11C10H1464.6°60.0°
C6C11C10H15176.0°180.0°
C6C11H16H17119.4°120.0°
C7C6N4H3117.1°120.0°
C7C6N4N3106.5°95.0°
C7C6N4C572.5°85.5°
C6C7C8H4175.5°60.0°
C6C7C8H565.1°180.0°
C6C7H10H11119.3°119.9°
C7C6C11H16174.9°60.0°
C7C6C11H1765.5°180.0°
C6N4N3C5179.2°179.6°
C6N4N3N2179.5°180.0°
C6N4C5C1179.9°180.0°
C6N4C5H20.1°0.2°
N4C6C7H1059.7°60.0°
N4C6C7H1159.9°60.0°
N4C6C11H1660.0°60.0°
N4C6C11H1759.6°60.0°
N3N4C5C10.8°0.3°
N4N3N2C10.3°0.2°
N3N4C5H2179.2°179.8°
N3N4C6H310.6°25.0°
C5N4N3N20.3°0.4°
N4C5C1H2180.0°179.8°
N4C5C1N20.9°0.2°
N4C5C1C2178.9°179.8°
C5N4C6H3170.3°154.6°
N3N2C1C50.8°0.0°
N3N2C1C2179.0°180.0°
C5C1N2C2178.2°180.0°
C5C1C2O38.5°0.0°
C5C1C2N1163.1°179.7°
N2C1C2O3173.7°180.0°
N2C1C2N114.7°0.3°
N2C1C5H2179.1°180.0°
C1C2O3N1171.1°179.7°
C1C2N1C3162.9°179.7°
C2C1C5H21.1°0.0°
C1C2N1H617.1°0.2°
O3C2N1C38.5°0.0°
O3C2N1H6171.6°179.9°
C2N1C3H6180.0°180.0°
C2N1C3B1103.0°105.0°
C2N1C3C4131.0°135.0°
C2N1C3H715.5°15.0°
N1C3B1O245.6°30.0°
N1C3C4C1248.9°55.0°
N1C3B1C4125.0°120.0°
N1C3B1H7119.3°120.0°
N1C3C4H7116.2°120.0°
N1C3B1O174.1°150.0°
N1C3C4C1671.3°175.0°
N1C3C4H1169.0°65.0°
O2B1C3O1119.7°180.0°
O2B1C3C4170.5°90.0°
O2B1C3H773.7°150.0°
O2B1O1H8180.0°180.0°
C13C12C4H18120.4°119.9°
C13C12C4H19120.4°120.0°
C13C12C4C3174.8°180.0°
C12C13C14H20120.3°120.0°
C12C13C14H21120.3°120.0°
C12C13C14C1555.2°60.0°
C13C12C4C1654.6°60.0°
C13C12C4H165.2°60.1°
C13C12H18H19118.6°120.0°
C12C13H20H21119.1°120.0°
C12C13C14H2265.0°60.0°
C12C13C14H23175.4°180.0°
C12C4C3B179.5°174.9°
C12C4C3C16120.2°120.1°
C12C4C3H1120.1°120.0°
C4C12C13C1455.9°60.0°
C12C4C16H1119.7°120.0°
C12C4C16C1554.5°60.0°
C12C4C3H7165.1°65.0°
C4C12H18H19118.7°120.1°
C4C12C13H20176.2°180.0°
C4C12C13H2164.3°60.0°
C12C4C16H26175.0°180.0°
C12C4C16H2766.0°60.0°
B1C3C4H7115.4°120.0°
B1C3C4C16160.3°65.0°
B1C3C4H140.6°55.0°
B1C3N1H677.0°75.1°
C3B1O1H860.1°0.0°
C3B1O2H9180.0°0.0°
C4C3B1O150.8°90.0°
C3C4C16H1119.6°119.9°
C3C4C16C15175.1°180.0°
C4C3N1H648.9°45.0°
C3C4C12H1864.7°60.1°
C3C4C12H1954.4°60.0°
C3C4C16H2664.4°60.0°
C3C4C16H2754.7°60.1°
O1B1C3H7166.5°30.0°
O1B1O2H960.0°179.9°
C13C14C15H22120.2°120.0°
C13C14C15H23120.2°120.0°
C13C14C15C1655.0°60.0°
C14C13C12H18176.3°60.0°
C14C13C12H1964.5°180.0°
C14C13H20H21119.1°120.0°
C13C14H22H23119.4°120.0°
C13C14C15H24175.3°180.0°
C13C14C15H2565.2°60.0°
C14C15C16C455.7°60.0°
C14C15C16H24120.3°120.0°
C14C15C16H25120.3°120.1°
C15C14C13H20175.5°180.0°
C15C14C13H2165.1°60.0°
C15C14H22H23119.3°120.1°
C14C15H24H25119.1°120.0°
C14C15C16H26176.2°180.0°
C14C15C16H2764.7°60.0°
C4C16C15H26120.5°120.0°
C4C16C15H27120.5°119.9°
C16C4C3H744.9°55.1°
C16C4C12H18175.0°59.9°
C16C4C12H1965.8°180.0°
C4C16C15H24176.0°180.0°
C4C16C15H2564.5°60.1°
C4C16H26H27118.6°120.0°
C15C16C4H165.2°60.1°
C16C15C14H2265.2°60.0°
C16C15C14H23175.3°180.0°
C16C15H24H25119.2°120.0°
C15C16H26H27118.6°120.0°
H1C4C3H774.8°175.0°
H1C4C12H1855.2°180.0°
H1C4C12H19174.4°60.0°
H1C4C16H2655.2°60.0°
H1C4C16H27174.3°180.0°
H3C6C7H10177.1°60.0°
H3C6C7H1157.6°180.0°
H3C6C11H1657.8°180.0°
H3C6C11H17177.3°60.0°
H4C8C7H1055.3°60.0°
H4C8C7H1164.3°179.9°
H4C8C9H1256.2°60.0°
H4C8C9H1363.4°180.0°
H5C8C7H10174.6°60.0°
H5C8C7H1155.1°60.1°
H5C8C9H12175.6°60.0°
H5C8C9H1356.0°60.0°
H6N1C3H7164.5°165.0°
H12C9C10H14175.9°60.0°
H12C9C10H1556.5°60.1°
H13C9C10H1456.3°180.0°
H13C9C10H1563.1°59.9°
H14C10C11H1655.6°NaN°
H14C10C11H17175.2°60.0°
H15C10C11H1663.8°60.0°
H15C10C11H1755.8°60.0°
H18C12C13H2063.4°60.0°
H18C12C13H2156.1°179.9°
H19C12C13H2055.8°59.9°
H19C12C13H21175.2°60.1°
H20C13C14H2255.3°60.1°
H20C13C14H2364.3°60.0°
H21C13C14H22174.7°179.9°
H21C13C14H2355.1°60.0°
H22C14C15H2455.1°60.0°
H22C14C15H25174.5°180.0°
H23C14C15H2464.4°60.1°
H23C14C15H2555.0°59.9°
H24C15C16H2663.6°60.0°
H24C15C16H2755.5°60.0°
H25C15C16H2655.9°60.0°
H25C15C16H27175.0°180.0°

225946

PDB entries from 2024-10-09

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