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A1BLQ

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C1N1sing1.47Å1.47Å
N1C2sing1.47Å1.48Å
N1C6sing1.47Å1.47Å
C2C3sing1.53Å1.52Å
C6C5sing1.53Å1.54Å
F3C15sing1.40Å1.30Å
F1C15sing1.40Å1.31Å
C3C4sing1.53Å1.53Å
C15C12sing1.51Å1.49Å
C15F2sing1.40Å1.31Å
N4N3doub1.28Å1.33ÅAromatic
N4C8sing1.33Å1.33ÅAromatic
N3C7sing1.32Å1.32ÅAromatic
C13C12doub1.38Å1.38ÅAromatic
C13C14sing1.39Å1.38ÅAromatic
C5C4sing1.53Å1.53Å
C5N2sing1.47Å1.46Å
C12C11sing1.38Å1.38ÅAromatic
O1C14sing1.36Å1.36Å
C14C9doub1.40Å1.39ÅAromatic
C11C10doub1.38Å1.38ÅAromatic
C9C10sing1.39Å1.39ÅAromatic
C9C8sing1.48Å1.48Å
C8C16doub1.40Å1.40ÅAromatic
N2C7sing1.39Å1.37Å
C7C21doub1.40Å1.41ÅAromatic
C16C21sing1.37Å1.40ÅAromatic
C16C17sing1.50Å1.52Å
C21C20sing1.50Å1.51Å
C17C18sing1.53Å1.52Å
C20C19sing1.53Å1.53Å
C19C18sing1.53Å1.51Å
C4H8sing1.09Å1.10Å
C4H9sing1.09Å1.10Å
C5H10sing1.09Å1.10Å
C6H11sing1.09Å1.10Å
C6H12sing1.09Å1.10Å
C10H14sing1.08Å1.08Å
C13H16sing1.08Å1.08Å
C17H19sing1.09Å1.10Å
C17H18sing1.09Å1.10Å
C20H25sing1.09Å1.10Å
C20H24sing1.09Å1.10Å
C1H3sing1.09Å1.10Å
C1H1sing1.09Å1.10Å
C1H2sing1.09Å1.10Å
C2H5sing1.09Å1.10Å
C2H4sing1.09Å1.10Å
C3H6sing1.09Å1.10Å
C3H7sing1.09Å1.10Å
N2H13sing0.97Å1.00Å
C11H15sing1.08Å1.08Å
O1H17sing0.97Å0.95Å
C18H20sing1.09Å1.10Å
C18H21sing1.09Å1.10Å
C19H23sing1.09Å1.10Å
C19H22sing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C1N1C2112.0°111.0°
C1N1C6112.5°111.0°
N1C1H3109.5°109.4°
N1C1H1109.4°109.5°
N1C1H2109.5°109.4°
C2N1C6110.3°111.2°
N1C2C3110.5°109.5°
N1C2H5109.2°109.4°
N1C2H4109.2°109.5°
N1C6C5111.0°109.5°
N1C6H11109.1°109.4°
N1C6H12109.1°109.5°
C2C3C4109.9°109.3°
C3C2H5109.2°109.5°
C3C2H4109.2°109.4°
C2C3H6109.3°109.5°
C2C3H7109.4°109.5°
C6C5C4109.3°109.3°
C6C5N2112.0°109.5°
C6C5H10107.9°109.5°
C5C6H11109.1°109.5°
C5C6H12109.1°109.5°
F3C15F1105.2°109.5°
F3C15C12112.7°109.5°
F3C15F2105.0°109.4°
F1C15C12114.5°109.5°
F1C15F2105.6°109.4°
C3C4C5110.5°109.1°
C3C4H8109.3°109.5°
C3C4H9109.2°109.5°
C4C3H6109.4°109.5°
C4C3H7109.4°109.5°
C12C15F2113.0°109.5°
C15C12C13119.1°119.8°
C15C12C11121.9°119.8°
N3N4C8121.2°122.0°
N4N3C7121.4°122.2°
N4C8C9113.4°120.1°
N4C8C16121.2°119.8°
N3C7N2115.6°120.0°
N3C7C21120.7°119.9°
C12C13C14120.4°120.1°
C13C12C11119.0°120.3°
C12C13H16119.8°120.0°
C13C14O1121.1°120.1°
C13C14C9121.0°119.8°
C14C13H16119.8°119.9°
C4C5N2110.6°109.5°
C5C4H8109.2°109.6°
C5C4H9109.2°109.5°
C4C5H10108.1°109.5°
C5N2C7125.3°120.0°
N2C5H10108.9°109.5°
C5N2H13105.4°120.0°
C12C11C10120.4°120.2°
C12C11H15119.8°119.9°
O1C14C9118.0°120.1°
C14O1H17109.5°114.0°
C14C9C10118.4°119.7°
C14C9C8120.3°120.2°
C11C10C9120.8°119.9°
C11C10H14119.6°120.0°
C10C11H15119.8°119.9°
C10C9C8121.2°120.1°
C9C10H14119.6°120.1°
C9C8C16125.4°120.1°
C8C16C21117.8°118.1°
C8C16C17120.7°119.1°
N2C7C21123.6°120.0°
C7N2H13105.4°120.0°
C7C21C16117.7°118.1°
C7C21C20121.0°119.1°
C21C16C17121.5°122.8°
C16C21C20121.3°122.8°
C16C17C18111.9°110.4°
C16C17H19108.8°109.3°
C16C17H18108.9°109.3°
C21C20C19113.4°110.4°
C21C20H25108.5°109.3°
C21C20H24108.5°109.2°
C17C18C19109.0°108.5°
C18C17H19108.9°109.3°
C18C17H18108.9°109.3°
C17C18H20109.6°109.6°
C17C18H21109.6°109.6°
C20C19C18110.3°108.6°
C19C20H25108.4°109.3°
C19C20H24108.5°109.3°
C20C19H23109.2°109.6°
C20C19H22109.3°109.6°
C19C18H20109.6°109.6°
C19C18H21109.6°109.8°
C18C19H23109.3°109.6°
C18C19H22109.2°109.6°
H8C4H9109.5°109.5°
H11C6H12109.5°109.4°
H19C17H18109.5°109.2°
H25C20H24109.5°109.3°
H3C1H1109.5°109.5°
H3C1H2109.5°109.5°
H1C1H2109.5°109.5°
H5C2H4109.5°109.5°
H6C3H7109.5°109.5°
H20C18H21109.5°109.7°
H23C19H22109.5°109.8°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C1N1C2C6126.2°124.1°
C1N1C2C3172.9°174.2°
C1N1C6C5173.6°174.1°
C1N1C6H1166.2°65.8°
C1N1C6H1253.4°54.1°
N1C1H3H1120.0°120.0°
N1C1H3H2120.0°119.9°
N1C1H1H2120.0°120.0°
C1N1C2H552.8°54.1°
C1N1C2H466.9°65.8°
N1C2C3H5120.2°120.0°
N1C2C3H4120.2°120.0°
C2N1C6C560.6°61.7°
N1C2C3C458.4°59.2°
C2N1C6H1159.7°58.3°
C2N1C6H12179.2°178.3°
C2N1C1H3180.0°56.0°
C2N1C1H160.0°176.0°
C2N1C1H260.0°64.0°
N1C2H5H4119.5°120.0°
N1C2C3H661.7°179.1°
N1C2C3H7178.4°60.8°
C6N1C2C360.9°61.7°
N1C6C5H11120.2°120.0°
N1C6C5H12120.2°120.1°
N1C6C5C457.5°59.2°
N1C6C5N2179.6°179.1°
N1C6C5H1059.8°60.8°
N1C6H11H12119.3°120.0°
C6N1C1H355.0°179.7°
C6N1C1H164.9°59.7°
C6N1C1H2175.1°60.3°
C6N1C2H5178.9°178.3°
C6N1C2H459.2°58.3°
C2C3C4H6120.0°120.0°
C2C3C4H7120.1°120.0°
C2C3C4C555.9°57.7°
C2C3C4H8176.0°62.3°
C2C3C4H964.3°177.6°
C3C2H5H4119.5°120.0°
C2C3H6H7119.8°120.1°
C6C5C4C354.9°57.7°
C6C5C4N2123.7°119.9°
C6C5C4H10117.1°120.0°
C6C5N2H10119.2°120.1°
C6C5N2C783.9°85.2°
C6C5C4H8175.1°62.2°
C6C5C4H965.2°177.6°
C5C6H11H12119.3°120.0°
C6C5N2H13154.0°94.8°
F3C15F1C12124.3°120.1°
F3C15F1F2110.7°120.0°
F3C15C12F2118.8°120.0°
F3C15C12C1346.6°150.0°
F3C15C12C11134.2°29.7°
F1C15C12F2121.0°120.0°
F1C15C12C13166.8°30.0°
F1C15C12C1114.0°149.8°
C3C4C5H8120.2°119.9°
C3C4C5H9120.1°119.9°
C3C4C5N2178.6°177.6°
C3C4H8H9119.6°120.1°
C3C4C5H1062.2°62.3°
C4C3C2H5178.5°179.2°
C4C3C2H461.8°60.8°
C4C3H6H7119.8°120.1°
C15C12C13C11179.2°179.7°
C15C12C13C14179.3°179.9°
C15C12C11C10179.6°179.7°
C15C12C13H160.7°0.0°
C15C12C11H150.4°0.3°
F2C15C12C1372.2°90.0°
F2C15C12C11107.0°90.3°
N3N4C8C9179.9°180.0°
N3N4C8C161.1°0.0°
N4N3C7N2178.0°179.9°
N4N3C7C211.7°0.2°
C8N4N3C71.2°0.2°
N4C8C9C1466.6°51.6°
N4C8C9C10110.2°128.3°
N4C8C9C16179.0°179.9°
N4C8C16C211.4°0.2°
N4C8C16C17179.6°179.5°
N3C7N2C536.4°0.1°
N3C7N2C21176.2°180.0°
N3C7C21C162.1°0.1°
N3C7C21C20179.9°179.7°
N3C7N2H13158.6°180.0°
C12C13C14H16180.0°180.0°
C12C13C14O1179.5°180.0°
C12C13C14C90.8°0.2°
C13C12C11C100.4°0.1°
C13C12C11H15179.5°180.0°
C14C13C12C110.1°0.2°
C13C14O1C9179.7°179.8°
C13C14C9C101.7°0.1°
C13C14C9C8178.6°180.0°
C13C14O1H17180.0°90.1°
C4C5N2H10118.6°120.1°
C4C5N2C7154.0°155.0°
C5C4H8H9119.5°120.2°
C4C5C6H1162.8°60.8°
C4C5C6H12177.7°179.3°
C5C4C3H664.2°177.7°
C5C4C3H7175.9°62.3°
C4C5N2H1331.8°25.0°
C5N2C7H13122.1°180.0°
C5N2C7C21147.3°180.0°
N2C5C4H861.2°57.7°
N2C5C4H958.5°62.5°
N2C5C6H1160.1°59.1°
N2C5C6H1259.4°60.8°
C12C11C10H15180.0°179.9°
C12C11C10C91.4°0.4°
C12C11C10H14178.6°180.0°
C11C12C13H16179.9°179.7°
O1C14C9C10178.5°179.7°
O1C14C9C81.7°0.2°
O1C14C13H160.5°0.0°
C14C9C10C112.0°0.4°
C14C9C10C8176.8°179.9°
C14C9C8C16112.5°128.4°
C14C9C10H14177.9°180.0°
C9C14C13H16179.2°179.8°
C9C14O1H170.3°89.7°
C11C10C9H14180.0°179.6°
C11C10C9C8178.8°179.7°
C10C9C8C1670.8°51.7°
C9C10C11H15178.6°179.7°
C9C8C16C21179.6°179.7°
C9C8C16C170.6°0.5°
C8C9C10H141.2°0.1°
C8C16C21C71.9°0.3°
C8C16C21C17178.9°179.7°
C8C16C21C20179.7°179.5°
C8C16C17C18159.9°162.6°
C8C16C17H1979.7°77.2°
C8C16C17H1839.5°42.3°
N2C7C21C16178.1°179.9°
N2C7C21C204.0°0.3°
C7N2C5H1035.4°34.9°
C7C21C16C20177.8°179.8°
C7C21C16C17179.2°179.5°
C7C21C20C19169.0°162.6°
C7C21C20H2570.4°77.1°
C7C21C20H2448.4°42.4°
C21C7N2H1325.2°0.0°
C21C16C17C1821.2°17.7°
C16C21C20C1913.2°17.6°
C21C16C17H1999.2°102.6°
C21C16C17H18141.5°138.0°
C16C21C20H25107.3°102.7°
C16C21C20H24133.8°137.8°
C17C16C21C201.3°0.7°
C16C17C18H19120.3°120.3°
C16C17C18H18120.4°120.3°
C16C17C18C1952.4°50.8°
C16C17H19H18118.9°119.6°
C16C17C18H20172.3°170.5°
C16C17C18H2167.5°69.0°
C21C20C19H25120.6°120.3°
C21C20C19H24120.6°120.1°
C21C20C19C1845.0°50.8°
C21C20H25H24118.2°119.5°
C21C20C19H23165.2°170.5°
C21C20C19H2275.1°68.9°
C17C18C19C2065.4°69.6°
C17C18C19H20119.9°119.7°
C17C18C19H21119.9°119.8°
C18C17H19H18118.9°119.5°
C17C18H20H21120.2°120.4°
C17C18C19H23174.5°170.7°
C17C18C19H2254.7°50.2°
C20C19C18H23120.1°119.7°
C20C19C18H22120.1°119.8°
C19C20H25H24118.2°119.6°
C20C19C18H20174.7°170.7°
C20C19C18H2154.5°50.2°
C20C19H23H22119.6°120.5°
C19C18C17H1968.0°69.5°
C19C18C17H18172.7°171.1°
C18C19C20H2575.5°69.5°
C18C19C20H24165.6°170.9°
C19C18H20H21120.2°120.6°
C18C19H23H22119.6°120.5°
H8C4C5H1057.9°177.8°
H8C4C3H656.0°57.7°
H8C4C3H763.9°177.7°
H9C4C5H10177.6°57.6°
H9C4C3H6175.7°62.5°
H9C4C3H755.8°57.6°
H10C5C6H11180.0°179.2°
H10C5C6H1260.5°59.3°
H10C5N2H1386.8°145.1°
H14C10C11H151.5°0.1°
H19C17C18H2051.9°50.2°
H19C17C18H21172.1°170.7°
H18C17C18H2067.4°69.2°
H18C17C18H2152.8°51.2°
H25C20C19H2344.6°50.2°
H25C20C19H22164.3°170.7°
H24C20C19H2374.2°69.4°
H24C20C19H2245.5°51.2°
H3C1H1H2120.0°120.0°
H5C2C3H658.4°60.9°
H5C2C3H761.4°59.2°
H4C2C3H6178.1°59.1°
H4C2C3H758.3°179.2°
H20C18C19H2354.5°51.0°
H20C18C19H2265.2°69.5°
H21C18C19H2365.6°69.5°
H21C18C19H22174.7°169.9°

247947

PDB entries from 2026-01-21

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