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9JL

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
FC1Msing1.35Å1.35Å
C1IC1Mdoub1.38Å1.40ÅAromatic
C1IC1Hsing1.38Å1.40ÅAromatic
C1MC1Esing1.39Å1.40ÅAromatic
C1HC1Gdoub1.39Å1.39ÅAromatic
C1EC1Dsing1.51Å1.51Å
C1EC1Fdoub1.38Å1.39ÅAromatic
C1DN12sing1.47Å1.46Å
N12C1Csing1.37Å1.37Å
C1GC1Fsing1.39Å1.38ÅAromatic
C1GOsing1.36Å1.35Å
C1FC1Ksing1.52Å1.50Å
N15C1Ptrip1.14Å1.14Å
C1QC1Odoub1.36Å1.36ÅAromatic
C1QN13sing1.37Å1.36ÅAromatic
C1PC1Osing1.43Å1.44Å
C1CN13sing1.37Å1.41ÅAromatic
C1CN1doub1.31Å1.31ÅAromatic
OC1Lsing1.44Å1.48Å
C1ON14sing1.35Å1.37ÅAromatic
C1KC1Lsing1.55Å1.56Å
N13C1Nsing1.38Å1.37ÅAromatic
N1C1Bsing1.33Å1.38ÅAromatic
C1NN14doub1.31Å1.32ÅAromatic
C1NC1Asing1.47Å1.44ÅAromatic
C1BC1Adoub1.38Å1.38ÅAromatic
C1AC19sing1.48Å1.46Å
C19C18doub1.39Å1.40ÅAromatic
C19C1sing1.40Å1.41ÅAromatic
CC1sing1.51Å1.52Å
C18C17sing1.38Å1.39ÅAromatic
C1C12doub1.38Å1.40ÅAromatic
C17C13doub1.38Å1.39ÅAromatic
C12C13sing1.38Å1.40ÅAromatic
C13C14sing1.51Å1.53Å
C14Nsing1.47Å1.49Å
C16Nsing1.47Å1.48Å
NC15sing1.47Å1.47Å
C14H1sing1.09Å1.10Å
C14H2sing1.09Å1.10Å
C15H3sing1.09Å1.10Å
C15H4sing1.09Å1.10Å
C15H5sing1.09Å1.10Å
C17H6sing1.08Å1.08Å
CH8sing1.09Å1.10Å
CH9sing1.09Å1.10Å
CH10sing1.09Å1.10Å
C12H11sing1.08Å1.08Å
C16H12sing1.09Å1.10Å
C16H13sing1.09Å1.10Å
C16H14sing1.09Å1.10Å
C18H15sing1.08Å1.08Å
C1BH16sing1.08Å1.08Å
C1DH17sing1.09Å1.10Å
C1DH18sing1.09Å1.10Å
C1HH19sing1.08Å1.08Å
C1IH20sing1.08Å1.08Å
C1KH21sing1.09Å1.10Å
C1LH22sing1.09Å1.10Å
C1QH23sing1.08Å1.08Å
N12H24sing0.97Å1.00Å
C1KH7sing1.09Å1.10Å
C1LH25sing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
FC1MC1I117.2°120.1°
FC1MC1E119.7°120.2°
C1MC1IC1H119.0°120.3°
C1IC1MC1E123.0°119.7°
C1MC1IH20120.5°119.9°
C1IC1HC1G117.8°120.3°
C1IC1HH19121.1°119.9°
C1HC1IH20120.5°119.8°
C1MC1EC1D122.8°120.0°
C1MC1EC1F117.0°120.0°
C1HC1GC1F123.0°118.9°
C1HC1GO124.9°129.9°
C1GC1HH19121.1°119.8°
C1DC1EC1F120.2°120.0°
C1EC1DN12111.5°109.5°
C1EC1DH17109.0°109.4°
C1EC1DH18109.0°109.5°
C1EC1FC1G120.2°120.8°
C1EC1FC1K128.9°132.1°
C1DN12C1C120.5°120.0°
N12C1DH17109.0°109.5°
N12C1DH18108.9°109.5°
C1DN12H24106.6°120.0°
N12C1CN13117.2°119.1°
N12C1CN1121.4°119.0°
C1CN12H24106.7°120.1°
C1FC1GO112.0°111.2°
C1GC1FC1K110.9°107.0°
C1GOC1L109.5°109.3°
C1FC1KC1L101.2°101.9°
C1FC1KH21111.5°111.0°
C1FC1KH7111.5°110.9°
N15C1PC1O179.7°179.9°
C1OC1QN13105.4°107.0°
C1QC1OC1P124.6°125.9°
C1QC1ON14110.8°108.2°
C1OC1QH23127.3°126.5°
C1QN13C1C130.7°133.3°
C1QN13C1N108.0°107.1°
N13C1QH23127.3°126.5°
C1PC1ON14124.6°125.9°
N13C1CN1121.4°121.9°
C1CN13C1N121.3°119.5°
C1CN1C1B119.3°122.7°
OC1LC1K106.3°102.8°
OC1LH22110.3°110.8°
OC1LH25110.3°110.7°
C1ON14C1N105.6°109.0°
C1LC1KH21111.5°111.0°
C1KC1LH22110.3°110.8°
C1LC1KH7111.5°110.9°
C1KC1LH25110.2°110.7°
N13C1NN14110.2°108.6°
N13C1NC1A117.2°117.9°
N1C1BC1A122.6°120.2°
N1C1BH16118.7°119.9°
N14C1NC1A132.5°133.4°
C1NC1AC1B118.2°117.7°
C1NC1AC19122.4°121.2°
C1BC1AC19119.4°121.1°
C1AC1BH16118.7°119.9°
C1AC19C18116.8°120.1°
C1AC19C1124.5°120.1°
C18C19C1118.7°119.8°
C19C18C17121.2°119.8°
C19C18H15119.4°120.1°
C19C1C121.6°120.1°
C19C1C12119.6°119.8°
CC1C12118.8°120.1°
C1CH8109.5°109.5°
C1CH9109.5°109.4°
C1CH10109.5°109.4°
C18C17C13120.6°120.2°
C18C17H6119.7°119.9°
C17C18H15119.4°120.1°
C1C12C13121.2°120.2°
C1C12H11119.4°119.9°
C17C13C12118.7°120.2°
C17C13C14119.1°119.9°
C13C17H6119.7°119.9°
C12C13C14122.2°119.9°
C13C12H11119.4°119.9°
C13C14N110.8°109.5°
C13C14H1109.1°109.5°
C13C14H2109.2°109.5°
C14NC16113.6°111.0°
C14NC15109.1°111.0°
NC14H1109.1°109.5°
NC14H2109.1°109.4°
C16NC15108.1°111.0°
NC16H12109.5°109.5°
NC16H13109.5°109.4°
NC16H14109.5°109.5°
NC15H3109.5°109.5°
NC15H4109.5°109.5°
NC15H5109.5°109.5°
H1C14H2109.5°109.5°
H3C15H4109.5°109.5°
H3C15H5109.4°109.5°
H4C15H5109.5°109.5°
H8CH9109.5°109.5°
H8CH10109.5°109.6°
H9CH10109.5°109.4°
H12C16H13109.5°109.5°
H12C16H14109.5°109.5°
H13C16H14109.5°109.5°
H17C1DH18109.4°109.5°
H21C1KH7109.5°110.8°
H22C1LH25109.5°110.8°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
FC1MC1IC1E179.4°179.9°
FC1MC1IC1H179.7°179.9°
FC1MC1EC1D1.8°0.0°
FC1MC1EC1F179.6°179.9°
FC1MC1IH200.3°0.1°
C1MC1IC1HH20180.0°180.0°
C1MC1IC1HC1G0.1°0.0°
C1IC1MC1EC1D178.8°179.9°
C1IC1MC1EC1F0.2°0.2°
C1MC1IC1HH19179.9°180.0°
C1HC1IC1MC1E0.3°0.2°
C1IC1HC1GH19180.0°180.0°
C1IC1HC1GC1F0.1°0.4°
C1IC1HC1GO179.9°179.3°
C1MC1EC1DC1F178.6°179.9°
C1MC1EC1DN1263.5°89.9°
C1MC1EC1FC1G0.0°0.2°
C1MC1EC1FC1K179.9°179.5°
C1MC1EC1DH17176.2°30.1°
C1MC1EC1DH1856.8°150.1°
C1EC1MC1IH20179.7°179.8°
C1HC1GC1FC1E0.2°0.4°
C1HC1GC1FO179.8°179.8°
C1HC1GC1FC1K179.9°179.4°
C1HC1GOC1L178.4°161.4°
C1GC1HC1IH20179.9°180.0°
C1EC1DN12H17120.3°120.0°
C1EC1DN12H18120.3°120.0°
C1EC1DN12C1C80.6°180.0°
C1DC1EC1FC1G178.7°179.7°
C1DC1EC1FC1K1.3°0.6°
C1EC1DH17H18119.1°120.0°
C1EC1DN12H24157.8°0.0°
C1FC1EC1DN12118.0°90.0°
C1EC1FC1GC1K179.9°179.8°
C1EC1FC1GO180.0°179.3°
C1EC1FC1KC1L178.7°164.2°
C1FC1EC1DH172.4°150.0°
C1FC1EC1DH18121.7°30.0°
C1EC1FC1KH2162.7°77.6°
C1EC1FC1KH760.0°46.1°
C1DN12C1CH24121.5°180.0°
C1DN12C1CN13178.7°180.0°
C1DN12C1CN12.0°0.0°
N12C1DH17H18119.1°120.0°
N12C1CN13C1Q0.4°0.0°
N12C1CN13N1179.3°180.0°
N12C1CN13C1N179.2°179.8°
N12C1CN1C1B179.5°179.8°
C1CN12C1DH1739.7°60.0°
C1CN12C1DH18159.0°60.0°
C1FC1GOC1L1.4°18.9°
C1GC1FC1KC1L1.4°15.5°
C1FC1GC1HH19179.8°179.7°
C1GC1FC1KH21117.2°102.7°
C1GC1FC1KH7120.1°133.6°
OC1GC1FC1K0.1°0.9°
C1GOC1LC1K2.2°27.7°
OC1GC1HH190.1°0.7°
C1GOC1LH22117.3°90.6°
C1GOC1LH25121.7°146.0°
C1FC1KC1LO2.1°25.4°
C1FC1KC1LH21118.6°118.3°
C1FC1KC1LH7118.7°118.1°
C1FC1KH21H7123.9°123.7°
C1FC1KC1LH22117.4°93.0°
C1FC1KC1LH25121.6°143.7°
N15C1PC1OC1Q1.7°70.3°
N15C1PC1ON14178.6°109.5°
C1OC1QN13H23180.0°179.6°
C1QC1OC1PN14179.7°179.7°
C1OC1QN13C1C179.8°179.9°
C1OC1QN13C1N0.1°0.4°
C1QC1ON14C1N0.1°0.2°
N13C1QC1OC1P179.7°179.9°
C1QN13C1CC1N179.6°179.8°
C1QN13C1CN1179.8°180.0°
N13C1QC1ON140.0°0.4°
C1QN13C1NN140.2°0.2°
C1QN13C1NC1A179.7°179.8°
C1PC1ON14C1N179.8°180.0°
C1PC1OC1QH230.3°0.3°
N13C1CN1C1B0.2°0.2°
C1CN13C1NN14179.9°180.0°
C1CN13C1NC1A0.6°0.0°
C1CN13C1QH230.2°0.3°
N13C1CN12H2457.1°0.0°
N1C1CN13C1N0.1°0.2°
C1CN1C1BC1A0.0°0.0°
C1CN1C1BH16180.0°180.0°
N1C1CN12H24123.5°180.0°
OC1LC1KH22119.5°118.4°
OC1LC1KH25119.5°118.3°
OC1LC1KH21116.5°92.9°
OC1LH22H25121.5°123.3°
OC1LC1KH7120.8°143.5°
C1ON14C1NN130.2°0.0°
C1ON14C1NC1A179.6°179.9°
N14C1OC1QH23180.0°179.9°
C1LC1KH21H7123.9°123.7°
C1KC1LH22H25121.4°123.3°
N13C1NN14C1A179.4°179.9°
N13C1NC1AC1B0.7°0.2°
N13C1NC1AC19179.5°180.0°
C1NN13C1QH23179.9°179.9°
N1C1BC1AC1N0.4°0.2°
N1C1BC1AH16180.0°180.0°
N1C1BC1AC19179.3°180.0°
N14C1NC1AC1B179.9°179.7°
N14C1NC1AC191.1°0.1°
C1NC1AC1BC19178.9°179.8°
C1NC1AC19C18117.4°75.2°
C1NC1AC19C163.5°104.8°
C1NC1AC1BH16179.6°179.8°
C1BC1AC19C1861.4°105.0°
C1BC1AC19C1117.7°75.0°
C1AC19C18C1179.2°180.0°
C1AC19C1C0.6°0.3°
C1AC19C18C17179.6°180.0°
C1AC19C1C12179.4°180.0°
C1AC19C18H150.4°0.1°
C19C1AC1BH160.7°0.0°
C18C19C1C179.7°179.7°
C19C18C17H15180.0°180.0°
C18C19C1C120.3°0.0°
C19C18C17C130.5°0.0°
C19C18C17H6179.5°179.9°
C19C1CC12180.0°179.7°
C1C19C18C170.4°0.0°
C19C1C12C130.3°0.0°
C19C1CH890.0°90.2°
C19C1CH9150.0°29.7°
C19C1CH1030.0°149.7°
C19C1C12H11179.7°179.9°
C1C19C18H15179.6°180.0°
CC1C12C13179.8°179.8°
C1CH8H9120.0°120.0°
C1CH8H10120.0°120.0°
C1CH9H10120.0°119.9°
CC1C12H110.2°0.3°
C18C17C13H6180.0°179.9°
C18C17C13C120.4°0.1°
C18C17C13C14179.8°180.0°
C1C12C13C170.3°0.1°
C1C12C13H11180.0°179.9°
C1C12C13C14179.7°180.0°
C12C1CH890.0°90.0°
C12C1CH930.0°150.0°
C12C1CH10150.0°30.1°
C17C13C12C14179.4°180.0°
C17C13C14N104.9°90.0°
C17C13C14H1134.9°149.9°
C17C13C14H215.3°30.0°
C17C13C12H11179.7°180.0°
C13C17C18H15179.5°179.9°
C12C13C14N75.7°90.0°
C12C13C14H144.5°30.0°
C12C13C14H2164.1°150.0°
C12C13C17H6179.6°179.9°
C13C14NH1120.2°120.0°
C13C14NH2120.2°120.0°
C13C14NC1666.6°66.0°
C13C14NC15172.7°170.0°
C13C14H1H2119.4°120.0°
C14C13C17H60.1°0.1°
C14C13C12H110.3°0.1°
C14NC16C15121.2°124.0°
NC14H1H2119.4°120.0°
C14NC15H3180.0°60.0°
C14NC15H460.0°179.9°
C14NC15H560.0°60.0°
C14NC16H12180.0°60.0°
C14NC16H1360.0°179.9°
C14NC16H1460.0°60.1°
C16NC14H1173.2°174.0°
C16NC14H253.6°54.0°
C16NC15H356.0°64.0°
C16NC15H4176.0°56.1°
C16NC15H564.0°176.1°
NC16H12H13120.0°120.0°
NC16H12H14120.0°120.0°
NC16H13H14120.0°120.0°
C15NC14H152.5°50.0°
C15NC14H267.1°70.0°
NC15H3H4120.0°120.0°
NC15H3H5120.0°120.0°
NC15H4H5120.0°120.0°
C15NC16H1258.8°176.0°
C15NC16H1361.2°56.1°
C15NC16H14178.8°63.9°
H3C15H4H5120.0°120.0°
H6C17C18H150.5°0.0°
H8CH9H10120.0°120.1°
H12C16H13H14120.0°120.0°
H17C1DN12H2481.9°120.0°
H18C1DN12H2437.5°120.0°
H19C1HC1IH200.0°0.0°
H21C1KC1LH22123.9°148.8°
H21C1KC1LH253.0°25.4°
H22C1LC1KH71.2°25.1°
H7C1KC1LH25119.7°98.2°

222415

PDB entries from 2024-07-10

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