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1C0

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
N02C01sing1.47Å1.42Å
N02C03sing1.35Å1.40Å
O04C03doub1.22Å1.26Å
C03C05sing1.47Å1.53Å
O19B18sing1.42Å1.46Å
F22C21sing1.35Å1.34Å
C32C33sing1.53Å1.49Å
C32C31sing1.53Å1.49Å
C33C31sing1.53Å1.50Å
C05C30sing1.48Å1.40ÅAromatic
C05C06doub1.38Å1.45ÅAromatic
C35C36doub1.38Å1.41ÅAromatic
C35C34sing1.40Å1.40ÅAromatic
C36C37sing1.39Å1.37ÅAromatic
B18C20sing1.57Å1.60Å
B18O17sing1.42Å1.42Å
C29C30doub1.39Å1.42ÅAromatic
C29C28sing1.38Å1.43ÅAromatic
C21C20doub1.39Å1.44ÅAromatic
C21C23sing1.39Å1.38ÅAromatic
C30C08sing1.40Å1.41ÅAromatic
C34C06sing1.47Å1.39Å
C34C40doub1.40Å1.41ÅAromatic
C37F38sing1.35Å1.29Å
C37C39doub1.39Å1.42ÅAromatic
C06O07sing1.34Å1.37ÅAromatic
C31C28sing1.51Å1.50Å
C20C15sing1.40Å1.28ÅAromatic
O17C16sing1.43Å1.42Å
C28C10doub1.39Å1.43ÅAromatic
C23C13doub1.38Å1.34ÅAromatic
C40C39sing1.38Å1.39ÅAromatic
C08O07sing1.35Å1.37ÅAromatic
C08C09doub1.39Å1.40ÅAromatic
C15C16sing1.51Å1.54Å
C15C14doub1.38Å1.43ÅAromatic
C10C09sing1.39Å1.41ÅAromatic
C10N11sing1.40Å1.48Å
C13C14sing1.38Å1.36ÅAromatic
C13C12sing1.51Å1.54Å
C12N11sing1.46Å1.41Å
N11S24sing1.66Å1.61Å
O26S24doub1.42Å1.47Å
S24O27doub1.42Å1.47Å
S24C25sing1.81Å1.78Å
C01H1sing1.09Å1.10Å
C01H2sing1.09Å1.10Å
C01H3sing1.09Å1.10Å
N02H4sing0.97Å1.00Å
C09H5sing1.08Å1.08Å
C12H6sing1.09Å1.10Å
C12H7sing1.09Å1.10Å
C14H8sing1.08Å1.08Å
C16H9sing1.09Å1.10Å
C16H10sing1.09Å1.10Å
O19H11sing0.97Å0.95Å
C23H12sing1.08Å1.08Å
C25H13sing1.09Å1.10Å
C25H14sing1.09Å1.10Å
C25H15sing1.09Å1.10Å
C29H16sing1.08Å1.08Å
C31H17sing1.09Å1.10Å
C32H18sing1.09Å1.10Å
C32H19sing1.09Å1.10Å
C33H20sing1.09Å1.10Å
C33H21sing1.09Å1.10Å
C35H22sing1.08Å1.08Å
C36H23sing1.08Å1.08Å
C39H24sing1.08Å1.08Å
C40H25sing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C01N02C03119.2°120.0°
N02C01H1109.5°109.4°
N02C01H2109.5°109.4°
N02C01H3109.5°109.4°
C01N02H4120.4°120.0°
N02C03O04116.1°120.0°
N02C03C05123.4°120.0°
C03N02H4120.4°120.0°
O04C03C05119.4°120.0°
C03C05C30122.5°127.2°
C03C05C06131.5°127.3°
O19B18C20125.1°126.5°
O19B18O17113.9°126.5°
B18O19H11109.5°114.0°
F22C21C20119.7°120.2°
F22C21C23120.3°120.2°
C33C32C3160.3°60.0°
C32C33C3159.9°60.0°
C33C32H18120.0°117.5°
C33C32H19119.9°117.5°
C32C33H20120.0°117.5°
C32C33H21120.0°117.5°
C32C31C3359.7°60.0°
C32C31C28138.6°117.5°
C32C31H17108.8°117.5°
C31C32H18119.9°117.4°
C31C32H19119.9°117.5°
C33C31C28121.6°117.5°
C33C31H17108.7°117.5°
C31C33H20120.0°117.5°
C31C33H21120.0°117.5°
C30C05C06105.8°105.5°
C05C30C29132.6°133.9°
C05C30C08107.6°105.7°
C05C06C34132.0°125.3°
C05C06O07108.9°109.3°
C36C35C34119.4°119.8°
C35C36C37120.4°120.1°
C36C35H22120.3°120.1°
C35C36H23119.8°119.9°
C35C34C06121.7°120.1°
C35C34C40119.8°119.8°
C34C35H22120.3°120.1°
C36C37F38119.8°119.8°
C36C37C39120.3°120.3°
C37C36H23119.8°120.0°
C20B18O17105.8°107.1°
B18C20C21131.9°133.0°
B18C20C15108.1°106.9°
B18O17C16108.2°108.8°
C30C29C28120.1°119.8°
C29C30C08119.7°120.4°
C30C29H16119.9°120.1°
C29C28C31119.9°119.9°
C29C28C10118.8°120.1°
C28C29H16119.9°120.1°
C20C21C23119.9°119.6°
C21C20C15119.9°120.1°
C21C23C13119.4°120.0°
C21C23H12120.3°119.9°
C30C08O07109.6°108.0°
C30C08C09121.0°119.3°
C06C34C40117.1°120.1°
C34C06O07119.1°125.3°
C34C40C39120.1°119.8°
C34C40H25120.0°120.1°
F38C37C39119.9°119.9°
C37C39C40119.5°120.1°
C37C39H24120.2°119.9°
C06O07C08108.1°111.5°
C31C28C10121.1°120.0°
C28C31H17108.7°115.5°
C20C15C16110.1°107.9°
C20C15C14120.3°119.7°
O17C16C15107.0°109.3°
O17C16H9110.1°109.5°
O17C16H10110.1°109.5°
C28C10C09120.4°120.5°
C28C10N11125.0°119.7°
C23C13C14120.5°120.5°
C23C13C12121.9°119.7°
C13C23H12120.3°120.1°
C40C39H24120.2°119.9°
C39C40H25119.9°120.1°
O07C08C09129.4°132.7°
C08C09C10119.9°120.0°
C08C09H5120.0°120.0°
C16C15C14129.6°132.4°
C15C16H9110.1°109.5°
C15C16H10110.1°109.5°
C15C14C13119.9°120.1°
C15C14H8120.0°119.9°
C09C10N11114.4°119.7°
C10C09H5120.1°120.0°
C10N11C12119.4°120.0°
C10N11S24117.8°120.0°
C14C13C12117.6°119.8°
C13C14H8120.1°120.0°
C13C12N11118.0°109.5°
C13C12H6107.3°109.5°
C13C12H7107.3°109.5°
C12N11S24122.6°120.0°
N11C12H6107.3°109.4°
N11C12H7107.3°109.5°
N11S24O26111.1°104.3°
N11S24O27110.3°104.3°
N11S24C25107.3°104.5°
O26S24O27108.7°121.0°
O26S24C25108.3°110.5°
O27S24C25111.2°110.5°
S24C25H13109.5°109.4°
S24C25H14109.5°109.5°
S24C25H15109.5°109.5°
H1C01H2109.5°109.5°
H1C01H3109.4°109.5°
H2C01H3109.4°109.5°
H6C12H7109.5°109.5°
H9C16H10109.5°109.5°
H13C25H14109.5°109.4°
H13C25H15109.5°109.5°
H14C25H15109.4°109.5°
H18C32H19109.5°115.6°
H20C33H21109.5°115.6°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C01N02C03H4180.0°180.0°
C01N02C03O04165.1°0.0°
C01N02C03C052.9°180.0°
N02C01H1H2120.0°120.0°
N02C01H1H3120.0°119.9°
N02C01H2H3120.0°120.0°
N02C03O04C05168.5°180.0°
N02C03C05C30120.1°90.0°
N02C03C05C0665.6°90.3°
C03N02C01H1180.0°60.0°
C03N02C01H260.0°60.0°
C03N02C01H360.0°180.0°
O04C03C05C3047.5°90.0°
O04C03C05C06126.9°89.7°
O04C03N02H414.9°180.0°
C03C05C30C06175.6°179.7°
C03C05C30C291.2°0.8°
C03C05C30C08175.2°179.9°
C03C05C06C341.8°0.1°
C03C05C06O07174.8°180.0°
C05C03N02H4177.1°0.0°
O19B18C20O17135.5°180.0°
O19B18C20C2138.2°0.0°
O19B18C20C15139.4°180.0°
O19B18O17C16149.0°180.0°
F22C21C20B182.9°0.1°
F22C21C20C23178.8°179.8°
F22C21C20C15179.7°180.0°
F22C21C23C13179.7°179.7°
F22C21C23H120.3°0.2°
C33C32C31H18109.6°107.5°
C33C32C31H19109.6°107.5°
C32C33C31H20109.4°107.5°
C32C33C31H21109.5°107.5°
C33C32C31C28104.8°107.5°
C33C32C31H17101.2°107.5°
C33C32H18H19144.6°145.8°
C32C33H20H21144.8°145.7°
C32C31C28C2956.9°57.0°
C32C31C28H17154.0°145.6°
C32C31C28C10117.8°123.1°
C31C32H18H19144.5°145.6°
C33C31C28C2921.8°11.6°
C33C31C28H17127.3°145.7°
C33C31C28C10163.5°168.3°
C31C33H20H21144.8°145.6°
C05C30C29C08176.1°179.0°
C05C30C29C28177.2°179.6°
C30C05C06C34176.9°179.8°
C30C05C06O070.2°0.3°
C05C30C08O070.4°0.4°
C05C30C08C09179.0°179.8°
C05C30C29H162.8°0.0°
C05C06C34C3527.7°0.3°
C06C05C30C29176.9°179.5°
C06C05C30C080.4°0.4°
C05C06C34O07176.4°179.9°
C05C06C34C40165.9°180.0°
C05C06O07C080.0°0.0°
C36C35C34H22180.0°179.9°
C35C36C37H23180.0°180.0°
C36C35C34C06174.8°180.0°
C36C35C34C408.8°0.3°
C35C36C37F38178.6°180.0°
C35C36C37C391.8°0.0°
C34C35C36C376.2°0.0°
C35C34C06C40166.4°179.7°
C35C34C06O07148.7°179.8°
C35C34C40C396.9°0.5°
C34C35C36H23173.8°180.0°
C35C34C40H25173.1°179.8°
C36C37F38C39179.6°180.0°
C36C37C39C400.1°0.2°
C37C36C35H22173.8°180.0°
C36C37C39H24179.9°180.0°
B18C20C21C15177.4°180.0°
B18C20C21C23178.3°179.7°
C20B18O17C167.8°0.0°
B18C20C15C161.5°0.0°
B18C20C15C14177.9°180.0°
C20B18O19H11132.5°180.0°
O17B18C20C21173.7°180.0°
O17B18C20C153.9°0.0°
B18O17C16C158.7°0.0°
B18O17C16H9110.9°120.0°
B18O17C16H10128.4°119.9°
O17B18O19H110.0°0.0°
C30C29C28H16180.0°179.6°
C30C29C28C31176.8°179.7°
C30C29C28C102.0°0.3°
C29C30C08O07177.4°179.6°
C29C30C08C092.0°0.5°
C28C29C30C081.0°0.6°
C29C28C31C10174.6°179.9°
C29C28C10C094.2°0.0°
C29C28C10N11179.7°180.0°
C29C28C31H17149.1°157.4°
C20C21C23C131.0°0.5°
C21C20C15C16179.4°180.0°
C21C20C15C140.0°0.0°
C20C21C23H12179.0°180.0°
C23C21C20C150.9°0.2°
C21C23C13H12180.0°179.5°
C21C23C13C140.0°0.5°
C21C23C13C12179.0°179.8°
C30C08O07C060.3°0.2°
C30C08O07C09179.4°179.8°
C30C08C09C100.1°0.2°
C30C08C09H5179.9°179.8°
C08C30C29H16179.0°179.0°
C06C34C40C39173.5°179.7°
C34C06O07C08177.1°180.0°
C06C34C35H225.3°0.0°
C06C34C40H256.4°0.1°
C34C40C39C372.4°0.5°
C40C34C06O0717.6°0.0°
C34C40C39H25180.0°179.7°
C40C34C35H22171.3°179.8°
C34C40C39H24177.6°179.7°
F38C37C39C40179.5°179.7°
F38C37C36H231.4°0.0°
F38C37C39H240.5°0.1°
C37C39C40H24180.0°179.8°
C39C37C36H23178.2°180.0°
C37C39C40H25177.6°179.8°
C06O07C08C09179.1°180.0°
C31C28C10C09178.9°179.9°
C31C28C10N115.0°0.0°
C31C28C29H163.2°0.7°
C28C31C32H184.7°145.0°
C28C31C32H19145.6°0.0°
C28C31C33H20119.2°0.0°
C28C31C33H2121.9°145.0°
C20C15C16O176.4°0.0°
C20C15C16C14179.3°180.0°
C20C15C14C131.0°0.1°
C20C15C14H8179.0°179.9°
C20C15C16H9113.2°120.0°
C20C15C16H10126.0°119.9°
O17C16C15H9119.6°120.0°
O17C16C15H10119.6°119.9°
O17C16C15C14172.9°180.0°
O17C16H9H10121.1°120.1°
C28C10C09C083.3°0.0°
C28C10C09N11176.5°180.0°
C28C10N11C1293.6°94.3°
C28C10N11S2491.3°85.8°
C28C10C09H5176.7°180.0°
C10C28C29H16178.0°179.2°
C10C28C31H1736.2°22.6°
C23C13C14C151.0°0.3°
C23C13C14C12179.0°179.7°
C23C13C12N11101.5°90.3°
C23C13C12H619.7°149.7°
C23C13C12H7137.2°29.8°
C23C13C14H8179.0°179.8°
O07C08C09C10179.5°180.0°
O07C08C09H50.5°0.0°
C08C09C10H5180.0°180.0°
C08C09C10N11179.8°180.0°
C16C15C14C13179.8°180.0°
C16C15C14H80.3°0.1°
C15C16H9H10121.1°120.1°
C15C14C13H8180.0°179.9°
C15C14C13C12180.0°180.0°
C14C15C16H967.5°60.0°
C14C15C16H1053.3°60.1°
C09C10N11C1290.0°85.7°
C09C10N11S2485.1°94.2°
C10N11C12C1378.9°85.0°
C10N11C12S24174.8°179.9°
C10N11S24O2615.8°32.7°
C10N11S24O27136.4°160.6°
C10N11S24C25102.4°83.3°
N11C10C09H50.2°0.0°
C10N11C12H642.3°155.0°
C10N11C12H7159.9°35.0°
C14C13C12N1177.5°90.0°
C14C13C12H6161.3°30.0°
C14C13C12H743.7°150.0°
C14C13C23H12180.0°180.0°
C13C12N11H6121.2°120.0°
C13C12N11H7121.2°120.0°
C13C12N11S24106.3°94.9°
C13C12H6H7116.2°120.0°
C12C13C14H80.1°0.1°
C12C13C23H121.0°0.2°
C12N11S24O26169.3°147.3°
C12N11S24O2748.7°19.5°
C12N11S24C2572.5°96.6°
N11C12H6H7116.1°120.0°
N11S24O26O27121.5°116.8°
N11S24O26C25117.6°111.8°
N11S24O27C25118.9°111.8°
S24N11C12H6132.5°25.0°
S24N11C12H715.0°145.0°
N11S24C25H13180.0°53.5°
N11S24C25H1460.0°173.5°
N11S24C25H1560.0°66.5°
O26S24O27C25119.0°131.5°
O26S24C25H1360.0°58.1°
O26S24C25H1460.1°61.9°
O26S24C25H15180.0°178.1°
O27S24C25H1359.3°165.2°
O27S24C25H14179.3°74.9°
O27S24C25H1560.7°45.2°
S24C25H13H14120.0°120.0°
S24C25H13H15120.0°120.0°
S24C25H14H15120.0°120.0°
H1C01H2H3119.9°120.1°
H1C01N02H40.0°120.0°
H2C01N02H4120.0°120.0°
H3C01N02H4120.0°0.0°
H13C25H14H15120.0°120.0°
H17C31C32H18149.2°0.0°
H17C31C32H198.4°144.9°
H17C31C33H208.1°145.0°
H17C31C33H21149.3°0.0°
H18C32C33H20141.0°145.1°
H18C32C33H210.1°0.0°
H19C32C33H200.1°0.0°
H19C32C33H21141.0°145.0°
H22C35C36H236.2°0.1°
H24C39C40H252.5°0.1°

222415

PDB entries from 2024-07-10

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