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L9T

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C14C13doub1.35Å1.35ÅAromatic
C14N2sing1.35Å1.35ÅAromatic
CC1sing1.51Å1.49Å
C13C12sing1.41Å1.45ÅAromatic
C7C6doub1.38Å1.39ÅAromatic
C7C8sing1.38Å1.38ÅAromatic
C6C5sing1.38Å1.39ÅAromatic
N2C15sing1.46Å1.45Å
N2N3sing1.40Å1.35ÅAromatic
C1C11doub1.35Å1.38ÅAromatic
C1Nsing1.32Å1.36ÅAromatic
C12N3doub1.32Å1.34ÅAromatic
C12C11sing1.48Å1.37Å
C8O2sing1.37Å1.38Å
C8C10doub1.39Å1.37ÅAromatic
C11Ssing1.76Å1.74ÅAromatic
O2C9sing1.44Å1.43Å
C5C4doub1.38Å1.40ÅAromatic
NC2doub1.30Å1.29ÅAromatic
C2N1sing1.39Å1.34Å
C2Ssing1.71Å1.74ÅAromatic
C10C4sing1.39Å1.39ÅAromatic
C10O1sing1.36Å1.38Å
N1C3sing1.46Å1.45Å
C4C3sing1.51Å1.50Å
C9O1sing1.44Å1.43Å
C3H1sing1.09Å1.10Å
C3H2sing1.09Å1.10Å
C7H3sing1.08Å1.08Å
C9H4sing1.09Å1.10Å
C9H5sing1.09Å1.10Å
C13H6sing1.08Å1.08Å
C14H7sing1.08Å1.08Å
C15H8sing1.09Å1.10Å
C15H9sing1.09Å1.10Å
C15H10sing1.09Å1.10Å
CH11sing1.09Å1.10Å
CH12sing1.09Å1.10Å
CH13sing1.09Å1.10Å
N1H14sing0.97Å1.00Å
C5H15sing1.08Å1.08Å
C6H16sing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C13C14N2106.4°108.0°
C14C13C12105.3°107.8°
C14C13H6127.3°126.1°
C13C14H7126.8°126.0°
C14N2C15127.3°125.9°
C14N2N3113.3°108.2°
N2C14H7126.8°126.0°
CC1C11128.2°122.8°
CC1N113.7°122.8°
C1CH11109.5°109.4°
C1CH12109.5°109.4°
C1CH13109.5°109.5°
C13C12N3109.4°107.9°
C13C12C11124.5°126.1°
C12C13H6127.3°126.1°
C6C7C8117.9°120.0°
C7C6C5120.2°120.2°
C6C7H3121.1°120.0°
C7C6H16119.9°119.9°
C7C8O2128.4°131.5°
C7C8C10122.0°119.9°
C8C7H3121.0°120.0°
C6C5C4120.6°120.1°
C6C5H15119.7°120.0°
C5C6H16119.9°119.9°
C15N2N3119.1°125.9°
N2C15H8109.5°109.5°
N2C15H9109.4°109.5°
N2C15H10109.5°109.5°
N2N3C12103.8°108.1°
C11C1N114.8°114.3°
C1C11C12112.5°126.0°
C1C11S108.8°108.0°
C1NC2110.8°117.0°
N3C12C11121.8°126.1°
C12C11S136.8°126.0°
O2C8C10109.5°108.6°
C8O2C9106.0°105.5°
C8C10C4119.3°119.8°
C8C10O1110.6°108.7°
C11SC288.3°90.4°
O2C9O1108.4°103.7°
O2C9H4109.7°110.6°
O2C9H5109.8°110.7°
C5C4C10117.4°120.0°
C5C4C3122.7°120.0°
C4C5H15119.7°119.9°
NC2N1121.6°124.9°
NC2S114.4°110.3°
N1C2S122.5°124.8°
C2N1C3128.0°119.9°
C2N1H14104.7°120.0°
C4C10O1128.1°131.6°
C10C4C3111.6°119.9°
C10O1C9105.2°105.5°
N1C3C4102.0°109.4°
N1C3H1111.3°109.5°
N1C3H2111.3°109.4°
C3N1H14104.7°120.0°
C4C3H1111.3°109.5°
C4C3H2111.3°109.4°
O1C9H4109.7°110.6°
O1C9H5109.7°110.5°
H1C3H2109.5°109.5°
H4C9H5109.5°110.5°
H8C15H9109.5°109.4°
H8C15H10109.5°109.5°
H9C15H10109.5°109.4°
H11CH12109.4°109.4°
H11CH13109.5°109.5°
H12CH13109.5°109.6°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C13C14N2H7180.0°180.0°
C14C13C12H6180.0°179.9°
C13C14N2C15178.5°179.9°
C13C14N2N37.6°0.0°
C14C13C12N38.8°0.0°
C14C13C12C11165.8°179.8°
N2C14C13C120.8°0.0°
C14N2C15N3173.6°179.9°
C14N2N3C1212.9°0.0°
N2C14C13H6179.2°180.0°
C14N2C15H8173.7°90.0°
C14N2C15H966.3°150.0°
C14N2C15H1053.7°30.0°
CC1C11N158.3°179.7°
CC1C11C124.1°0.3°
CC1C11S171.0°179.7°
CC1NC2179.5°179.7°
C1CH11H12120.0°119.9°
C1CH11H13120.0°120.0°
C1CH12H13120.0°120.0°
C13C12N3N212.8°0.0°
C13C12C11C111.7°179.7°
C13C12N3C11157.7°179.7°
C13C12C11S173.6°0.3°
C12C13C14H7179.2°180.0°
C6C7C8H3180.0°179.8°
C7C6C5H16180.0°180.0°
C6C7C8O2177.9°179.9°
C6C7C8C101.8°0.1°
C7C6C5C44.8°0.0°
C7C6C5H15175.2°180.0°
C8C7C6C52.1°0.0°
C7C8O2C10176.5°179.9°
C7C8O2C9178.6°162.7°
C7C8C10C412.6°0.1°
C7C8C10O1177.9°180.0°
C8C7C6H16177.9°180.0°
C6C5C4H15180.0°179.9°
C6C5C4C1015.3°0.0°
C6C5C4C3160.8°180.0°
C5C6C7H3177.9°179.7°
C15N2N3C12172.6°179.9°
C15N2C14H71.5°0.0°
N2C15H8H9120.0°120.0°
N2C15H8H10120.0°120.0°
N2C15H9H10120.0°120.0°
N2N3C12C11170.5°179.8°
N3N2C14H7172.4°180.0°
N3N2C15H80.0°89.9°
N3N2C15H9120.0°30.1°
N3N2C15H10120.0°150.1°
C1C11C12N3166.0°0.0°
C1C11C12S161.8°180.0°
C11C1NC219.0°0.1°
C1C11SC22.8°0.0°
C11C1CH11158.5°90.1°
C11C1CH1281.5°150.0°
C11C1CH1338.5°29.9°
NC1C11C12154.2°180.0°
NC1C11S12.8°0.0°
C1NC2N1149.9°180.0°
C1NC2S16.4°0.0°
NC1CH110.0°90.3°
NC1CH12120.0°29.6°
NC1CH13120.0°149.7°
N3C12C11S32.1°180.0°
N3C12C13H6171.2°180.0°
C12C11SC2159.4°180.0°
C11C12C13H614.2°0.3°
O2C8C10C4170.6°180.0°
O2C8C10O15.3°0.1°
C8O2C9O11.7°27.1°
O2C8C7H32.1°0.3°
C8O2C9H4118.1°91.5°
C8O2C9H5121.5°145.7°
C10C8O2C92.1°17.2°
C8C10C4C519.0°0.0°
C8C10C4O1162.4°179.9°
C8C10C4C3168.1°180.0°
C8C10O1C96.1°17.3°
C10C8C7H3178.2°179.8°
C11SC2N7.9°0.0°
C11SC2N1158.3°180.0°
O2C9O1C104.7°27.1°
O2C9O1H4119.8°118.6°
O2C9O1H5119.8°118.7°
O2C9H4H5120.5°122.9°
C5C4C10C3149.2°180.0°
C5C4C10O1178.6°180.0°
C5C4C3N150.1°100.0°
C5C4C3H168.6°140.0°
C5C4C3H2168.9°19.9°
C4C5C6H16175.2°179.9°
NC2N1S165.1°180.0°
NC2N1C3152.5°0.0°
NC2N1H1485.0°180.0°
C2N1C3H14122.5°180.0°
C2N1C3C4130.4°180.0°
C2N1C3H1110.8°60.0°
C2N1C3H211.6°60.1°
SC2N1C342.4°180.0°
SC2N1H1480.1°0.0°
C10C4C3N197.2°80.0°
C4C10O1C9169.8°162.7°
C10C4C3H1144.1°40.0°
C10C4C3H221.6°160.0°
C10C4C5H15164.8°180.0°
O1C10C4C329.4°0.0°
C10O1C9H4115.1°91.4°
C10O1C9H5124.6°145.8°
N1C3C4H1118.8°120.0°
N1C3C4H2118.8°119.9°
N1C3H1H2123.5°120.0°
C4C3H1H2123.5°120.0°
C4C3N1H147.9°0.0°
C3C4C5H1519.2°0.0°
O1C9H4H5120.5°122.7°
H1C3N1H14126.7°120.0°
H2C3N1H14110.8°119.9°
H3C7C6H162.1°0.3°
H6C13C14H70.8°0.1°
H8C15H9H10120.0°120.0°
H11CH12H13120.0°120.1°
H15C5C6H164.8°0.0°

222036

PDB entries from 2024-07-03

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