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6EB

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C03N02sing1.36Å1.39ÅAromatic
C03N04doub1.30Å1.35ÅAromatic
C01N02sing1.47Å1.46Å
N02C06sing1.36Å1.37ÅAromatic
N04C05sing1.35Å1.40ÅAromatic
C06C05doub1.36Å1.38ÅAromatic
C05C07sing1.48Å1.43Å
N25C07sing1.32Å1.35ÅAromatic
N25C24doub1.32Å1.38ÅAromatic
C07C08doub1.41Å1.43ÅAromatic
C24C23sing1.37Å1.37ÅAromatic
C08N09sing1.34Å1.38ÅAromatic
C08C22sing1.42Å1.41ÅAromatic
N09C10doub1.32Å1.35ÅAromatic
F18C15sing1.40Å1.33Å
C23C22doub1.40Å1.39ÅAromatic
C12C13sing1.53Å1.54Å
C12O11sing1.43Å1.42Å
C22C20sing1.41Å1.46ÅAromatic
C14C13sing1.53Å1.27Å
C14C15sing1.53Å1.48Å
C10O11sing1.35Å1.36Å
C10N19sing1.33Å1.39ÅAromatic
C15F17sing1.40Å1.33Å
C15F16sing1.40Å1.32Å
C20N19doub1.32Å1.36ÅAromatic
C20O21sing1.35Å1.21Å
C13H1sing1.09Å1.10Å
C24H2sing1.08Å1.08Å
C01H3sing1.09Å1.10Å
C01H4sing1.09Å1.10Å
C01H5sing1.09Å1.10Å
C03H6sing1.08Å1.08Å
C06H7sing1.08Å1.08Å
C12H8sing1.09Å1.10Å
C12H9sing1.09Å1.10Å
C14H10sing1.09Å1.10Å
C23H12sing1.08Å1.08Å
C13H13sing1.09Å1.10Å
C14H14sing1.09Å1.10Å
O21H11sing0.97Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
N02C03N04110.5°108.9°
C03N02C01127.3°126.3°
C03N02C06106.3°107.4°
N02C03H6124.8°125.5°
C03N04C05106.2°109.2°
N04C03H6124.7°125.5°
C01N02C06126.4°126.3°
N02C01H3109.5°109.5°
N02C01H4109.4°109.4°
N02C01H5109.5°109.5°
N02C06C05108.2°106.7°
N02C06H7125.9°126.7°
N04C05C06108.3°107.7°
N04C05C07120.7°126.1°
C06C05C07129.3°126.1°
C05C06H7125.9°126.6°
C05C07N25114.4°120.2°
C05C07C08123.8°120.2°
C07N25C24118.1°122.7°
N25C07C08121.0°119.6°
N25C24C23124.7°121.9°
N25C24H2117.6°119.1°
C07C08N09119.4°122.8°
C07C08C22118.2°118.4°
C24C23C22117.4°118.8°
C23C24H2117.7°119.0°
C24C23H12121.3°120.6°
N09C08C22122.4°118.8°
C08N09C10115.7°120.3°
C08C22C23120.5°118.6°
C08C22C20119.5°118.5°
N09C10O11121.3°118.6°
N09C10N19125.4°122.8°
F18C15C14112.4°109.4°
F18C15F17105.7°109.5°
F18C15F16105.9°109.5°
C23C22C20120.0°122.9°
C22C23H12121.3°120.6°
C13C12O11113.6°109.5°
C12C13C14121.5°109.5°
C12C13H1106.4°109.5°
C13C12H8108.4°109.4°
C13C12H9108.5°109.5°
C12C13H13106.3°109.4°
C12O11C10114.7°117.0°
O11C12H8108.4°109.5°
O11C12H9108.4°109.5°
C22C20N19116.5°118.1°
C22C20O21123.5°120.9°
C13C14C15125.2°109.5°
C14C13H1106.4°109.5°
C13C14H10105.4°109.5°
C14C13H13106.4°109.5°
C13C14H14105.4°109.5°
C14C15F17112.1°109.5°
C14C15F16112.6°109.5°
C15C14H10105.4°109.4°
C15C14H14105.4°109.5°
O11C10N19113.3°118.6°
C10N19C20120.4°121.5°
F17C15F16107.5°109.5°
N19C20O21120.0°120.9°
C20O21H11109.5°114.0°
H1C13H13109.5°109.5°
H3C01H4109.4°109.5°
H3C01H5109.5°109.5°
H4C01H5109.5°109.4°
H8C12H9109.5°109.5°
H10C14H14109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
N02C03N04H6180.0°179.9°
C03N02C01C06179.1°179.7°
N02C03N04C054.4°0.0°
C03N02C06C053.6°0.4°
C03N02C01H3180.0°89.7°
C03N02C01H460.0°30.4°
C03N02C01H560.0°150.3°
C03N02C06H7176.4°179.7°
N04C03N02C01179.8°180.0°
N04C03N02C060.5°0.3°
C03N04C05C066.5°0.2°
C03N04C05C07172.9°179.9°
C01N02C06C05175.6°179.9°
N02C01H3H4120.0°120.0°
N02C01H3H5120.0°120.0°
N02C01H4H5120.0°120.0°
C01N02C03H60.2°0.1°
C01N02C06H74.3°0.0°
N02C06C05N046.3°0.3°
N02C06C05H7180.0°180.0°
N02C06C05C07171.2°179.9°
C06N02C01H30.9°90.0°
C06N02C01H4120.9°150.0°
C06N02C01H5119.1°30.0°
C06N02C03H6179.5°179.8°
N04C05C06C07164.8°179.7°
N04C05C07N252.1°155.5°
N04C05C07C08172.1°25.0°
C05N04C03H6175.6°180.0°
N04C05C06H7173.7°179.7°
C06C05C07N25161.1°24.1°
C06C05C07C088.9°155.3°
C05C07N25C08170.3°179.4°
C05C07N25C24173.4°179.7°
C05C07C08N099.7°0.1°
C05C07C08C22173.4°180.0°
C07C05C06H78.8°0.0°
C07N25C24C231.3°0.6°
N25C07C08N09179.0°179.5°
N25C07C08C224.1°0.5°
C07N25C24H2178.7°179.5°
C24N25C07C083.2°0.8°
N25C24C23H2180.0°179.9°
N25C24C23C220.2°0.1°
N25C24C23H12179.8°180.0°
C07C08N09C22176.7°179.9°
C07C08N09C10177.5°180.0°
C07C08C22C233.0°0.0°
C07C08C22C20179.0°179.7°
C24C23C22C081.2°0.2°
C24C23C22H12180.0°179.9°
C24C23C22C20179.2°179.9°
N09C08C22C23179.8°180.0°
N09C08C22C202.2°0.2°
C08N09C10O11179.8°180.0°
C08N09C10N190.5°0.2°
C22C08N09C100.8°0.0°
C08C22C23C20178.0°179.8°
C08C22C20N192.2°0.3°
C08C22C20O21178.2°179.8°
C08C22C23H12178.8°179.7°
N09C10O11C1211.6°179.7°
N09C10O11N19179.7°179.8°
N09C10N19C200.4°0.2°
F18C15C14C1382.2°180.0°
F18C15C14F17119.0°120.0°
F18C15C14F16119.5°120.0°
F18C15F17F16112.8°120.0°
F18C15C14H1039.9°60.0°
F18C15C14H14155.6°60.0°
C23C22C20N19179.7°180.0°
C23C22C20O210.2°0.0°
C22C23C24H2179.8°180.0°
C13C12O11H8120.6°119.9°
C13C12O11H9120.6°120.0°
C12C13C14H1121.7°120.0°
C12C13C14H13121.6°120.0°
C12C13C14C15177.8°180.0°
C13C12O11C10154.4°180.0°
C12C13H1H13114.5°120.0°
C13C12H8H9118.2°120.0°
C12C13C14H1055.7°60.0°
C12C13C14H1460.1°60.0°
O11C12C13C1499.5°180.0°
C12O11C10N19168.6°0.1°
O11C12C13H122.1°60.0°
O11C12H8H9118.1°120.0°
O11C12C13H13138.8°60.1°
C22C20N19C101.0°0.1°
C22C20N19O21179.6°180.0°
C20C22C23H120.8°0.0°
C22C20O21H11179.5°90.0°
C13C14C15H10122.1°120.0°
C13C14C15H14122.1°120.0°
C13C14C15F17158.8°60.0°
C13C14C15F1637.3°60.0°
C14C13H1H13114.6°120.0°
C14C13C12H821.0°60.0°
C14C13C12H9139.8°60.0°
C13C14H10H14112.9°120.0°
C14C15F17F16124.3°120.0°
C15C14C13H160.5°60.0°
C15C14H10H14112.9°120.0°
C15C14C13H1356.1°60.0°
O11C10N19C20179.9°180.0°
C10O11C12H833.8°60.1°
C10O11C12H985.0°59.9°
C10N19C20O21179.4°180.0°
F17C15C14H1079.1°60.0°
F17C15C14H1436.6°180.0°
F16C15C14H10159.4°180.0°
F16C15C14H1484.8°60.0°
N19C20O21H110.0°90.0°
H1C13C12H8142.7°60.0°
H1C13C12H998.5°180.0°
H1C13C14H10177.3°180.0°
H1C13C14H1461.6°60.0°
H2C24C23H120.3°0.1°
H3C01H4H5120.0°120.0°
H8C12C13H13100.6°180.0°
H9C12C13H1318.2°60.0°
H10C14C13H1366.0°60.0°
H13C13C14H14178.3°180.0°

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