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SummaryGeometryRelated PDB entries

4NX

Bonds
First atomSecond atomBond order typeDistance
(experimental model)		Distance
(ideal model)		Properties
CL2C9sing1.74Å1.76Å
C10C9doub1.38Å1.40ÅAromatic
C10C11sing1.38Å1.39ÅAromatic
CL1C40sing1.74Å1.76Å
C9C8sing1.38Å1.39ÅAromatic
C39C40doub1.38Å1.39ÅAromatic
C39C38sing1.38Å1.39ÅAromatic
C11C6doub1.38Å1.39ÅAromatic
C40C41sing1.38Å1.38ÅAromatic
O20C16doub1.22Å1.23Å
C38C37doub1.38Å1.39ÅAromatic
C8C7doub1.38Å1.37ÅAromatic
C6C7sing1.38Å1.38ÅAromatic
C6C5sing1.51Å1.52Å
C41C42doub1.38Å1.39ÅAromatic
C16O18sing1.35Å1.45Å
C16C15sing1.41Å1.34Å
O18C13sing1.43Å1.44Å
C37C42sing1.38Å1.39ÅAromatic
C37C28sing1.51Å1.54Å
C5C13sing1.53Å1.55Å
C15C28sing1.51Å1.52Å
C15C14doub1.36Å1.38Å
C13C14sing1.51Å1.52Å
C13O21sing1.43Å1.43Å
C14C44sing1.46Å1.51Å
C44C48doub1.37Å1.41ÅAromatic
C44C45sing1.48Å1.49ÅAromatic
C48N49sing1.36Å1.37ÅAromatic
N49C46sing1.38Å1.35ÅAromatic
C45C59doub1.39Å1.40ÅAromatic
C45C46sing1.40Å1.48ÅAromatic
C59C58sing1.38Å1.39ÅAromatic
C46C56doub1.39Å1.38ÅAromatic
C58C57doub1.39Å1.40ÅAromatic
C56C57sing1.38Å1.39ÅAromatic
C57CL3sing1.74Å1.76Å
C39H1sing1.08Å1.08Å
C38H2sing1.08Å1.08Å
C41H3sing1.08Å1.08Å
C42H4sing1.08Å1.08Å
C28H5sing1.09Å1.10Å
C28H6sing1.09Å1.10Å
O21H7sing0.97Å0.95Å
C5H8sing1.09Å1.10Å
C5H9sing1.09Å1.10Å
C11H10sing1.08Å1.08Å
C10H11sing1.08Å1.08Å
C7H12sing1.08Å1.08Å
C8H13sing1.08Å1.08Å
C48H14sing1.08Å1.08Å
N49H15sing0.97Å1.00Å
C56H16sing1.08Å1.08Å
C58H17sing1.08Å1.08Å
C59H18sing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)		Angle
(ideal model)
CL2C9C10117.6°120.0°
CL2C9C8120.1°120.0°
C9C10C11117.6°119.9°
C10C9C8122.3°120.0°
C9C10H11121.2°120.0°
C10C11C6120.4°120.0°
C10C11H10119.8°120.0°
C11C10H11121.2°120.0°
CL1C40C39120.2°120.0°
CL1C40C41118.5°120.0°
C9C8C7119.0°120.0°
C9C8H13120.5°120.0°
C40C39C38118.6°120.0°
C39C40C41121.3°120.0°
C40C39H1120.7°120.0°
C39C38C37121.1°120.0°
C38C39H1120.7°120.0°
C39C38H2119.5°120.0°
C11C6C7120.5°120.1°
C11C6C5120.7°120.0°
C6C11H10119.8°120.0°
C40C41C42119.2°120.0°
C40C41H3120.4°120.0°
O20C16O18123.5°124.5°
O20C16C15127.3°124.6°
C38C37C42119.3°120.0°
C38C37C28123.8°120.0°
C37C38H2119.4°120.0°
C8C7C6120.1°120.0°
C8C7H12119.9°120.0°
C7C8H13120.5°120.0°
C7C6C5118.8°119.9°
C6C7H12120.0°120.0°
C6C5C13115.4°109.5°
C6C5H8108.0°109.5°
C6C5H9108.0°109.5°
C41C42C37120.4°120.0°
C42C41H3120.4°120.0°
C41C42H4119.8°120.0°
O18C16C15109.1°111.0°
C16O18C13108.7°108.0°
C16C15C28123.8°125.2°
C16C15C14110.7°109.6°
O18C13C5113.2°110.2°
O18C13C14102.1°105.4°
O18C13O21103.5°110.3°
C42C37C28116.8°120.0°
C37C42H4119.8°120.0°
C37C28C15116.6°109.5°
C37C28H5107.7°109.5°
C37C28H6107.7°109.4°
C5C13C14112.6°110.5°
C5C13O21113.9°110.3°
C13C5H8108.0°109.5°
C13C5H9108.0°109.4°
C28C15C14125.5°125.2°
C15C28H5107.7°109.5°
C15C28H6107.7°109.5°
C15C14C13108.9°106.0°
C15C14C44122.4°127.0°
C14C13O21110.6°110.1°
C13C14C44128.6°127.0°
C13O21H7109.5°114.0°
C14C44C48130.2°126.8°
C14C44C45123.7°126.8°
C48C44C45106.1°106.4°
C44C48N49109.7°109.7°
C44C48H14125.2°125.1°
C44C45C59134.8°134.0°
C44C45C46104.5°105.9°
C48N49C46112.0°110.5°
N49C48H14125.1°125.2°
C48N49H15124.0°124.8°
N49C46C45107.7°107.5°
N49C46C56133.1°133.1°
C46N49H15124.0°124.7°
C59C45C46120.7°120.2°
C45C59C58118.5°119.6°
C45C59H18120.8°120.2°
C45C46C56119.2°119.3°
C59C58C57119.8°120.3°
C59C58H17120.1°119.8°
C58C59H18120.8°120.2°
C46C56C57118.0°119.9°
C46C56H16121.0°120.0°
C58C57C56123.7°120.6°
C58C57CL3116.5°119.7°
C57C58H17120.1°119.9°
C56C57CL3119.7°119.7°
C57C56H16121.0°120.0°
H5C28H6109.4°109.5°
H8C5H9109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)		Torsion
(ideal model)
CL2C9C10C8178.7°179.8°
CL2C9C10C11179.9°180.0°
CL2C9C8C7177.8°179.8°
CL2C9C10H110.1°0.1°
CL2C9C8H132.2°0.3°
C9C10C11H11180.0°179.9°
C9C10C11C61.2°0.0°
C10C9C8C70.8°0.5°
C9C10C11H10178.8°180.0°
C10C9C8H13179.2°180.0°
C11C10C9C81.5°0.2°
C10C11C6H10180.0°180.0°
C10C11C6C71.2°0.0°
C10C11C6C5179.6°179.7°
CL1C40C39C41178.3°179.8°
CL1C40C39C38179.9°180.0°
CL1C40C41C42177.4°180.0°
CL1C40C39H10.1°0.1°
CL1C40C41H32.6°0.0°
C9C8C7H13180.0°179.5°
C9C8C7C63.3°0.4°
C8C9C10H11178.5°179.7°
C9C8C7H12176.7°179.5°
C40C39C38H1180.0°180.0°
C40C39C38C372.2°0.0°
C39C40C41C420.9°0.2°
C40C39C38H2177.8°180.0°
C39C40C41H3179.1°179.7°
C38C39C40C411.6°0.3°
C39C38C37H2180.0°180.0°
C39C38C37C420.3°0.3°
C39C38C37C28175.8°180.0°
C11C6C7C83.5°0.2°
C11C6C7C5178.4°179.7°
C11C6C5C1381.6°89.7°
C11C6C5H8157.6°150.3°
C11C6C5H939.3°30.2°
C6C11C10H11178.8°179.9°
C11C6C7H12176.5°179.7°
C40C41C42H3180.0°180.0°
C40C41C42C372.8°0.1°
C41C40C39H1178.4°179.7°
C40C41C42H4177.2°180.0°
O20C16O18C15177.4°179.9°
O20C16O18C13170.0°180.0°
O20C16C15C287.5°0.0°
O20C16C15C14172.4°179.8°
C38C37C42C412.2°0.4°
C38C37C42C28176.4°179.7°
C38C37C28C1518.6°85.4°
C37C38C39H1177.8°180.0°
C38C37C42H4177.8°179.7°
C38C37C28H5102.4°154.6°
C38C37C28H6139.7°34.6°
C8C7C6H12180.0°179.9°
C8C7C6C5178.0°180.0°
C7C6C5C13100.0°90.0°
C7C6C5H820.8°30.0°
C7C6C5H9139.1°150.0°
C7C6C11H10178.8°180.0°
C6C7C8H13176.7°180.0°
C6C5C13O1862.0°61.4°
C6C5C13H8120.9°120.0°
C6C5C13H9120.9°120.0°
C6C5C13C1453.1°177.5°
C6C5C13O21179.9°60.6°
C6C5H8H9117.3°120.0°
C5C6C11H100.4°0.3°
C5C6C7H121.9°0.0°
C41C42C37H4180.0°179.9°
C41C42C37C28178.6°180.0°
C16O18C13C5114.8°119.0°
O18C16C15C28175.2°180.0°
O18C16C15C144.9°0.3°
C16O18C13C146.5°0.2°
C16O18C13O21121.5°119.0°
C15C16O18C137.4°0.1°
C16C15C28C3785.3°85.6°
C16C15C28C14179.9°179.7°
C16C15C14C130.6°0.4°
C16C15C14C44176.1°179.7°
C16C15C28H535.8°34.4°
C16C15C28H6153.7°154.4°
O18C13C5C14115.2°116.1°
O18C13C5O21117.9°122.0°
O18C13C14C153.8°0.4°
O18C13C14O21109.6°118.9°
O18C13C14C44179.7°179.7°
O18C13O21H7180.0°61.4°
O18C13C5H8177.1°178.5°
O18C13C5H958.9°58.5°
C42C37C28C15165.2°94.3°
C42C37C38H2179.7°179.6°
C37C42C41H3177.2°180.0°
C42C37C28H573.7°25.7°
C42C37C28H644.2°145.7°
C37C28C15H5121.1°120.0°
C37C28C15H6121.0°120.0°
C37C28C15C1494.6°94.7°
C28C37C38H24.2°0.0°
C28C37C42H41.4°0.1°
C37C28H5H6116.8°120.0°
C5C13C14C15117.9°118.7°
C5C13C14O21128.7°122.0°
C5C13C14C4458.6°61.2°
C5C13O21H756.7°60.6°
C13C5H8H9117.3°120.0°
C28C15C14C13179.5°179.9°
C28C15C14C443.8°0.1°
C15C28H5H6116.8°120.0°
C15C14C13C44176.5°179.9°
C15C14C13O21113.4°119.3°
C15C14C44C4840.1°103.9°
C15C14C44C45139.2°76.4°
C14C15C28H5144.4°145.3°
C14C15C28H626.5°25.3°
C13C14C44C48136.0°76.0°
C13C14C44C4544.8°103.7°
C14C13O21H771.4°177.3°
C14C13C5H867.7°62.5°
C14C13C5H9174.0°57.5°
O21C13C14C4470.1°60.8°
O21C13C5H859.3°59.4°
O21C13C5H959.0°179.4°
C14C44C48C45179.3°179.7°
C14C44C48N49179.5°180.0°
C14C44C45C591.9°0.1°
C14C44C45C46179.9°179.9°
C14C44C48H140.5°0.0°
C44C48N49H14180.0°180.0°
C44C48N49C460.3°0.0°
C48C44C45C59178.7°179.7°
C48C44C45C460.5°0.4°
C44C48N49H15179.6°180.0°
C45C44C48N490.2°0.2°
C44C45C46N490.8°0.3°
C44C45C59C46177.9°180.0°
C44C45C59C58179.7°179.2°
C44C45C46C56179.0°179.8°
C45C44C48H14179.9°179.8°
C44C45C59H180.3°0.1°
C48N49C46H15180.0°180.0°
C48N49C46C450.7°0.2°
C48N49C46C56178.6°180.0°
N49C46C45C59179.2°179.7°
N49C46C45C56178.3°179.8°
N49C46C56C57179.5°180.0°
C46N49C48H14179.6°180.0°
N49C46C56H160.5°0.0°
C45C59C58H18180.0°179.0°
C59C45C46C562.5°0.1°
C45C59C58C572.6°1.0°
C45C59C58H17177.4°179.6°
C46C45C59C582.4°0.8°
C45C46C56C572.7°0.3°
C45C46N49H15179.3°179.8°
C45C46C56H16177.2°179.8°
C46C45C59H18177.6°179.8°
C59C58C57H17180.0°179.3°
C59C58C57C563.1°0.7°
C59C58C57CL3179.2°179.3°
C46C56C57C583.1°0.0°
C46C56C57H16180.0°179.9°
C46C56C57CL3179.2°180.0°
C56C46N49H151.4°0.0°
C58C57C56CL3176.1°179.9°
C58C57C56H16176.9°180.0°
C57C58C59H18177.4°179.9°
C56C57C58H17176.9°180.0°
CL3C57C56H160.8°0.1°
CL3C57C58H170.8°0.1°
H1C39C38H22.2°0.0°
H3C41C42H42.8°0.1°
H10C11C10H111.2°0.1°
H12C7C8H133.3°0.0°
H14C48N49H150.4°0.0°
H17C58C59H182.6°0.6°

225946

PDB entries from 2024-10-09

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