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3FO

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C3C2doub1.38Å1.39ÅAromatic
C3C4sing1.38Å1.39ÅAromatic
C2C1sing1.38Å1.41ÅAromatic
CL1C4sing1.74Å1.72Å
C4C5doub1.38Å1.39ÅAromatic
C1C6doub1.38Å1.40ÅAromatic
C5C6sing1.38Å1.37ÅAromatic
C6C7sing1.51Å1.51Å
N8C7sing1.47Å1.44Å
N8S12sing1.66Å1.61Å
C7C9sing1.51Å1.53Å
O15S12doub1.42Å1.44Å
S12O14doub1.42Å1.47Å
S12C13sing1.81Å1.81Å
O11C9doub1.21Å1.23Å
C9N10sing1.35Å1.35Å
O19C17doub1.21Å1.20Å
N10C16sing1.47Å1.48Å
C17C16sing1.51Å1.52Å
C17N18sing1.35Å1.36Å
C27N18sing1.47Å1.47Å
C27C28sing1.51Å1.51Å
C16C20sing1.53Å1.61Å
C28N29sing1.35Å1.38Å
C28O30doub1.21Å1.22Å
N29C31sing1.47Å1.48Å
C32N33doub1.28Å1.19Å
C32C31sing1.51Å1.46Å
C20C21sing1.51Å1.54Å
C22C21doub1.38Å1.40ÅAromatic
C22C23sing1.38Å1.40ÅAromatic
C21C26sing1.38Å1.42ÅAromatic
C23C24doub1.38Å1.39ÅAromatic
C26C25doub1.38Å1.42ÅAromatic
C24C25sing1.38Å1.41ÅAromatic
C1H1sing1.08Å1.08Å
C2H2sing1.08Å1.08Å
C3H3sing1.08Å1.08Å
C13H4sing1.09Å1.10Å
C13H5sing1.09Å1.10Å
C13H6sing1.09Å1.10Å
C16H7sing1.09Å1.10Å
C20H8sing1.09Å1.10Å
C20H9sing1.09Å1.10Å
C22H10sing1.08Å1.08Å
C23H11sing1.08Å1.08Å
C24H12sing1.08Å1.08Å
C25H13sing1.08Å1.08Å
C26H14sing1.08Å1.08Å
C27H15sing1.09Å1.10Å
C27H16sing1.09Å1.10Å
C5H17sing1.08Å1.08Å
C7H18sing1.09Å1.10Å
N8H19sing0.97Å1.00Å
N10H20sing0.97Å1.00Å
N18H21sing0.97Å1.00Å
N29H22sing0.97Å1.00Å
C31H23sing1.09Å1.10Å
C31H24sing1.09Å1.10Å
C32H25sing1.08Å1.08Å
N33H26sing0.97Å1.00Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C2C3C4119.7°120.0°
C3C2C1116.2°120.0°
C3C2H2121.9°120.1°
C2C3H3120.2°119.9°
C3C4CL1117.8°120.0°
C3C4C5124.1°120.0°
C4C3H3120.2°120.1°
C2C1C6123.3°120.0°
C2C1H1118.4°120.0°
C1C2H2121.9°120.0°
CL1C4C5118.0°120.0°
C4C5C6116.9°120.0°
C4C5H17121.5°120.0°
C1C6C5119.7°120.0°
C1C6C7119.7°120.0°
C6C1H1118.3°120.0°
C5C6C7120.6°120.0°
C6C5H17121.6°120.0°
C6C7N8103.2°109.5°
C6C7C9107.5°109.5°
C6C7H18110.0°109.5°
C7N8S12118.6°120.0°
N8C7C9115.0°109.5°
N8C7H18111.1°109.4°
C7N8H19107.2°120.0°
N8S12O15105.5°104.3°
N8S12O14104.8°104.3°
N8S12C13100.0°104.4°
S12N8H19107.2°120.0°
C7C9O11119.7°120.0°
C7C9N10116.6°120.0°
C9C7H18109.7°109.5°
O15S12O14118.2°121.0°
O15S12C13111.9°110.5°
O14S12C13114.0°110.5°
S12C13H4109.5°109.4°
S12C13H5109.4°109.5°
S12C13H6109.5°109.5°
O11C9N10123.6°120.0°
C9N10C16124.8°120.0°
C9N10H20117.6°120.0°
O19C17C16118.6°120.0°
O19C17N18121.3°120.0°
N10C16C17111.4°109.5°
N10C16C20108.6°109.5°
N10C16H7111.3°109.5°
C16N10H20117.6°120.0°
C16C17N18120.1°120.0°
C17C16C20105.0°109.5°
C17C16H7110.7°109.5°
C17N18C27119.1°120.0°
C17N18H21120.4°120.0°
N18C27C28107.2°109.5°
N18C27H15110.0°109.5°
N18C27H16110.0°109.5°
C27N18H21120.5°120.0°
C27C28N29120.4°120.0°
C27C28O30115.4°120.0°
C28C27H15110.0°109.5°
C28C27H16110.0°109.5°
C16C20C21108.2°109.5°
C20C16H7109.5°109.4°
C16C20H8109.8°109.4°
C16C20H9109.8°109.5°
N29C28O30124.3°120.0°
C28N29C31123.9°119.9°
C28N29H22118.0°120.1°
N29C31C32108.0°109.4°
C31N29H22118.0°120.0°
N29C31H23109.9°109.5°
N29C31H24109.8°109.5°
N33C32C31116.4°120.0°
N33C32H25121.8°120.0°
C32N33H26112.0°120.0°
C32C31H23109.8°109.5°
C32C31H24109.9°109.4°
C31C32H25121.8°120.0°
C20C21C22118.8°120.0°
C20C21C26122.1°120.0°
C21C20H8109.8°109.5°
C21C20H9109.8°109.5°
C21C22C23119.9°120.0°
C22C21C26119.1°120.0°
C21C22H10120.0°120.0°
C22C23C24121.1°120.0°
C23C22H10120.1°120.0°
C22C23H11119.4°120.0°
C21C26C25121.3°120.0°
C21C26H14119.3°120.0°
C23C24C25120.6°120.0°
C24C23H11119.4°120.0°
C23C24H12119.7°119.9°
C26C25C24117.8°120.0°
C26C25H13121.1°120.0°
C25C26H14119.3°120.0°
C25C24H12119.7°120.1°
C24C25H13121.1°120.0°
H4C13H5109.5°109.5°
H4C13H6109.5°109.5°
H5C13H6109.5°109.5°
H8C20H9109.4°109.5°
H15C27H16109.5°109.5°
H23C31H24109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C2C3C4H3180.0°180.0°
C3C2C1H2180.0°179.9°
C2C3C4CL1177.4°180.0°
C2C3C4C50.8°0.0°
C3C2C1C60.1°0.1°
C3C2C1H1179.9°179.7°
C4C3C2C10.6°0.0°
C3C4CL1C5176.8°180.0°
C3C4C5C62.8°0.1°
C4C3C2H2179.4°180.0°
C3C4C5H17177.2°180.0°
C2C1C6H1180.0°179.7°
C2C1C6C52.2°0.0°
C2C1C6C7179.8°179.7°
C1C2C3H3179.4°179.9°
CL1C4C5C6179.4°180.0°
CL1C4C3H32.6°0.0°
CL1C4C5H170.7°0.0°
C4C5C6C13.3°0.0°
C4C5C6H17180.0°180.0°
C4C5C6C7179.1°179.8°
C5C4C3H3179.2°180.0°
C1C6C5C7177.6°179.7°
C1C6C7N837.6°140.0°
C1C6C7C984.4°100.0°
C6C1C2H2179.9°180.0°
C1C6C5H17176.7°180.0°
C1C6C7H18156.2°20.0°
C5C6C7N8140.0°39.7°
C5C6C7C998.0°80.3°
C5C6C1H1177.8°179.7°
C5C6C7H1821.4°159.7°
C6C7N8C9116.8°120.0°
C6C7N8H18117.8°120.0°
C6C7N8S12165.1°95.0°
C6C7C9H18119.6°120.0°
C6C7C9O1193.5°100.0°
C6C7C9N1083.6°80.0°
C7C6C1H10.2°0.1°
C7C6C5H170.9°0.3°
C6C7N8H1973.6°85.0°
C7N8S12H19121.3°179.9°
N8C7C9H18126.1°120.0°
C7N8S12O15150.6°178.9°
C7N8S12O1483.9°51.0°
C7N8S12C1334.4°65.0°
N8C7C9O1120.8°20.0°
N8C7C9N10162.2°159.9°
S12N8C7C978.1°145.0°
N8S12O15O14116.7°116.8°
N8S12O15C13107.8°111.7°
N8S12O14C13108.3°111.7°
N8S12C13H4180.0°60.0°
N8S12C13H560.0°180.0°
N8S12C13H660.0°60.0°
S12N8C7H1847.2°25.0°
C7C9O11N10176.8°179.9°
C7C9N10C16179.6°180.0°
C9C7N8H1943.2°35.0°
C7C9N10H200.5°0.1°
O15S12O14C13134.6°131.5°
O15S12C13H468.7°51.6°
O15S12C13H551.3°68.3°
O15S12C13H6171.3°171.6°
O15S12N8H1988.1°1.0°
O14S12C13H468.8°171.6°
O14S12C13H5171.2°68.4°
O14S12C13H651.2°51.6°
O14S12N8H1937.4°128.9°
S12C13H4H5120.0°120.0°
S12C13H4H6120.0°120.0°
S12C13H5H6120.0°120.0°
C13S12N8H19155.7°115.1°
O11C9N10C163.6°0.1°
O11C9C7H18146.9°140.0°
O11C9N10H20176.4°180.0°
C9N10C16H20180.0°179.9°
C9N10C16C17129.2°155.0°
C9N10C16C20115.6°85.0°
C9N10C16H75.1°34.9°
N10C9C7H1836.1°40.0°
O19C17C16N1014.5°0.0°
O19C17C16N18178.1°180.0°
O19C17N18C271.5°0.0°
O19C17C16C20102.9°120.0°
O19C17C16H7139.0°120.0°
O19C17N18H21178.5°180.0°
N10C16C17C20117.4°120.0°
N10C16C17H7124.4°120.0°
N10C16C17N18167.3°180.0°
N10C16C20H7121.7°120.0°
N10C16C20C2179.0°65.0°
N10C16C20H840.8°55.0°
N10C16C20H9161.2°174.9°
C16C17N18C27176.5°180.0°
C17C16C20H7118.9°120.0°
C17C16C20C21161.6°175.0°
C17C16C20H878.5°65.0°
C17C16C20H941.8°55.0°
C17C16N10H2050.8°24.9°
C16C17N18H213.5°0.0°
C17N18C27H21180.0°180.0°
C17N18C27C28167.2°180.0°
N18C17C16C2075.2°60.0°
N18C17C16H742.9°60.0°
C17N18C27H1547.6°60.0°
C17N18C27H1673.2°60.0°
N18C27C28H15119.6°120.0°
N18C27C28H16119.7°120.0°
N18C27C28N29153.0°180.0°
N18C27C28O3027.3°0.0°
N18C27H15H16121.0°120.0°
C27C28N29O30179.6°179.9°
C27C28N29C31179.9°180.0°
C28C27H15H16121.0°120.0°
C28C27N18H2112.8°0.0°
C27C28N29H220.2°0.1°
C16C20C21H8119.8°120.0°
C16C20C21H9119.8°120.0°
C16C20C21C2290.3°89.7°
C16C20C21C2689.0°90.0°
C16C20H8H9120.6°120.0°
C20C16N10H2064.4°95.0°
C28N29C31H22180.0°180.0°
C28N29C31C32106.0°180.0°
N29C28C27H1533.4°60.0°
N29C28C27H1687.3°60.1°
C28N29C31H2313.7°60.0°
C28N29C31H24134.2°60.0°
O30C28N29C310.6°0.1°
O30C28C27H15147.0°119.9°
O30C28C27H1692.3°120.0°
O30C28N29H22179.4°180.0°
N29C31C32N33141.4°125.0°
N29C31C32H23119.8°120.0°
N29C31C32H24119.8°120.0°
N29C31H23H24120.7°120.1°
N29C31C32H2538.6°55.0°
N33C32C31H25180.0°180.0°
N33C32C31H2398.8°115.0°
N33C32C31H2421.7°5.0°
C32C31N29H2274.0°0.0°
C32C31H23H24120.7°119.9°
C31C32N33H26180.0°180.0°
C20C21C22C26179.3°179.7°
C20C21C22C23177.5°180.0°
C20C21C26C25178.1°180.0°
C21C20C16H742.7°55.0°
C21C20H8H9120.5°120.1°
C20C21C22H102.5°0.1°
C20C21C26H141.9°0.0°
C21C22C23H10180.0°179.9°
C21C22C23C240.9°0.1°
C22C21C26C251.2°0.3°
C22C21C20H829.5°150.3°
C22C21C20H9149.9°30.3°
C21C22C23H11179.1°179.9°
C22C21C26H14178.7°179.7°
C23C22C21C261.9°0.3°
C22C23C24H11180.0°180.0°
C22C23C24C250.8°0.2°
C22C23C24H12179.1°180.0°
C21C26C25H14180.0°180.0°
C21C26C25C240.4°0.0°
C26C21C20H8151.2°30.0°
C26C21C20H930.8°150.0°
C26C21C22H10178.2°179.8°
C21C26C25H13179.6°180.0°
C23C24C25C261.5°0.2°
C23C24C25H12180.0°179.8°
C24C23C22H10179.2°180.0°
C23C24C25H13178.5°179.7°
C26C25C24H13180.0°180.0°
C26C25C24H12178.5°180.0°
C25C24C23H11179.2°179.8°
C24C25C26H14179.6°180.0°
H1C1C2H20.1°0.3°
H2C2C3H30.6°0.0°
H4C13H5H6120.0°120.0°
H7C16C20H8162.5°175.0°
H7C16C20H977.1°65.0°
H7C16N10H20174.9°145.0°
H10C22C23H110.9°0.0°
H11C23C24H120.8°0.0°
H12C24C25H131.5°0.0°
H13C25C26H140.4°0.0°
H15C27N18H21132.4°120.0°
H16C27N18H21106.9°120.0°
H18C7N8H19168.5°155.0°
H22N29C31H23166.3°120.0°
H22N29C31H2445.8°119.9°
H23C31C32H2581.2°65.0°
H24C31C32H25158.3°175.0°
H25C32N33H260.0°0.0°

222415

PDB entries from 2024-07-10

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