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FSP

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C1C2sing1.53Å1.53Å
C1H11sing1.09Å1.12Å
C1H12sing1.09Å1.12Å
C1H13sing1.09Å1.12Å
C2C3sing1.53Å1.54Å
C2H21sing1.09Å1.12Å
C2H22sing1.09Å1.12Å
C3C4sing1.53Å1.53Å
C3H31sing1.09Å1.11Å
C3H32Asing1.09Å1.11Å
C4C5sing1.53Å1.58Å
C4H41sing1.09Å1.11Å
C4H42sing1.09Å1.11Å
C5N6sing1.46Å1.41Å
C5C23sing1.51Å1.53Å
C5H5sing1.09Å1.11Å
N6C7sing1.35Å1.33Å
N6HN6sing0.97Å1.02Å
C7O8doub1.22Å1.23Å
C7O9sing1.35Å1.28Å
O9C10sing1.45Å1.39Å
C10C11sing1.53Å1.51Å
C10H101sing1.09Å1.11Å
C10H102sing1.09Å1.12Å
C11C12sing1.53Å1.58Å
C11C20sing1.54Å1.52Å
C11C22sing1.54Å1.52Å
C12C13sing1.51Å1.52Å
C12H121sing1.09Å1.12Å
C12H122sing1.09Å1.12Å
C13C14doub1.38Å1.40ÅAromatic
C13C19sing1.38Å1.38ÅAromatic
C14C15sing1.38Å1.38ÅAromatic
C14H14sing1.08Å1.10Å
C15C16doub1.38Å1.38ÅAromatic
C15H15sing1.08Å1.10Å
C16F17sing1.35Å1.33Å
C16C18sing1.39Å1.39ÅAromatic
C18C19doub1.38Å1.38ÅAromatic
C18H18sing1.08Å1.10Å
C19H19sing1.08Å1.10Å
C20C21sing1.54Å1.53Å
C20H201sing1.09Å1.12Å
C20H202sing1.09Å1.11Å
C21C22sing1.54Å1.54Å
C21H211sing1.09Å1.12Å
C21H212sing1.09Å1.12Å
C22H221sing1.09Å1.12Å
C22H222sing1.09Å1.11Å
C25O26doub1.21Å1.23Å
C25N27sing1.35Å1.35Å
C25C23sing1.49Å1.50Å
N27C28sing1.39Å1.35Å
N27H27sing0.97Å1.02Å
C28C29doub1.36Å1.37ÅAromatic
C28N32sing1.36Å1.37ÅAromatic
C29C30sing1.40Å1.36ÅAromatic
C29H29sing1.08Å1.10Å
C30N31doub1.31Å1.40ÅAromatic
C30H30sing1.08Å1.10Å
N31N32sing1.40Å1.38ÅAromatic
N32H32sing0.97Å1.02Å
C23O24doub1.21Å1.33Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C2C1H11112.1°109.5°
C2C1H12109.8°109.5°
C2C1H13112.1°109.5°
C1C2C3109.8°109.4°
C1C2H21112.1°109.5°
C1C2H22112.1°109.4°
H11C1H12112.1°109.5°
H11C1H1398.4°109.4°
H12C1H13112.0°109.5°
C3C2H21112.1°109.5°
C3C2H22112.1°109.5°
C2C3C4109.6°109.4°
C2C3H31112.1°109.5°
C2C3H32A112.1°109.5°
H21C2H2298.4°109.5°
C4C3H31112.2°109.5°
C4C3H32A112.2°109.5°
C3C4C5111.7°109.4°
C3C4H41111.4°109.5°
C3C4H42111.4°109.5°
H31C3H32A98.3°109.5°
C5C4H41111.4°109.5°
C5C4H42111.4°109.4°
C4C5N6108.5°109.5°
C4C5C23105.8°109.5°
C4C5H5112.1°109.5°
H41C4H4299.0°109.5°
N6C5C23108.6°109.4°
N6C5H5109.6°109.5°
C5N6C7120.0°120.0°
C5N6HN6123.0°120.0°
C23C5H5112.1°109.5°
C5C23C25113.8°120.0°
C5C23O24120.6°120.0°
C7N6HN6117.0°119.9°
N6C7O8120.2°119.9°
N6C7O9118.9°120.0°
O8C7O9120.9°120.0°
C7O9C10113.1°120.0°
O9C10C11107.1°109.5°
O9C10H101113.1°109.5°
O9C10H102113.1°109.4°
C11C10H101113.1°109.5°
C11C10H102113.1°109.5°
C10C11C12113.4°112.9°
C10C11C20112.3°113.6°
C10C11C22111.2°113.6°
H101C10H10297.4°109.5°
C12C11C20114.0°113.6°
C12C11C22112.6°113.7°
C11C12C13110.1°109.5°
C11C12H121112.0°109.5°
C11C12H122112.0°109.4°
C20C11C2291.5°87.1°
C11C20C2189.3°87.1°
C11C20H201120.3°113.6°
C11C20H202120.3°113.7°
C11C22C2189.1°87.1°
C11C22H221120.4°113.6°
C11C22H222120.4°113.6°
C13C12H121112.0°109.5°
C13C12H122112.0°109.5°
C12C13C14120.3°119.9°
C12C13C19120.0°120.0°
H121C12H12298.4°109.5°
C14C13C19119.7°120.1°
C13C14C15119.9°120.0°
C13C14H14120.6°120.0°
C13C19C18120.2°120.1°
C13C19H19120.1°120.0°
C15C14H14119.5°120.0°
C14C15C16119.8°119.9°
C14C15H15120.3°120.0°
C16C15H15120.0°120.1°
C15C16F17120.1°120.0°
C15C16C18120.2°120.0°
F17C16C18119.7°120.0°
C16C18C19120.3°120.0°
C16C18H18120.3°120.0°
C19C18H18119.5°120.0°
C18C19H19119.8°119.9°
C21C20H201120.3°113.6°
C21C20H202120.3°113.6°
C20C21C2289.9°87.1°
C20C21H211120.0°113.6°
C20C21H212120.0°113.6°
H201C20H20289.7°112.9°
C22C21H211120.0°113.6°
C22C21H212120.0°113.6°
C21C22H221120.4°113.6°
C21C22H222120.4°113.6°
H211C21H21290.0°112.9°
H221C22H22289.6°112.9°
O26C25N27121.4°120.1°
O26C25C23120.9°120.0°
N27C25C23117.6°120.0°
C25N27C28122.5°120.0°
C25N27H27118.7°120.0°
C25C23O24118.9°120.0°
C28N27H27118.8°120.0°
N27C28C29124.7°126.2°
N27C28N32123.5°126.3°
C29C28N32111.8°107.5°
C28C29C30106.5°107.8°
C28C29H29126.8°126.1°
C28N32N31104.8°107.8°
C28N32H32127.3°126.1°
C30C29H29126.6°126.1°
C29C30N31107.6°108.5°
C29C30H30125.2°125.8°
N31C30H30127.2°125.8°
C30N31N32109.3°108.4°
N31N32H32127.8°126.1°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C2C1H11H12124.0°120.1°
C2C1H11H13118.0°120.0°
C2C1H12H13125.2°120.0°
C1C2C3H21125.3°120.0°
C1C2C3H22125.3°119.9°
C1C2H21H22118.0°120.0°
C1C2C3C460.3°180.0°
C1C2C3H3164.9°60.0°
C1C2C3H32A174.4°60.0°
H11C1H12H13109.5°119.9°
H11C1C2C354.7°59.9°
H11C1C2H2170.5°179.9°
H11C1C2H22180.0°60.0°
H12C1C2C3180.0°180.0°
H12C1C2H2154.8°60.0°
H12C1C2H2254.7°60.0°
H13C1C2C354.7°60.0°
H13C1C2H21180.0°60.0°
H13C1C2H2270.5°180.0°
C3C2H21H22118.0°120.1°
C2C3C4H31125.2°120.0°
C2C3C4H32A125.3°120.0°
C2C3H31H32A118.0°120.1°
C2C3C4C5164.4°180.0°
C2C3C4H4139.2°60.0°
C2C3C4H4270.3°60.0°
H21C2C3C4174.4°60.0°
H21C2C3H3160.3°180.0°
H21C2C3H32A49.2°60.0°
H22C2C3C464.9°60.1°
H22C2C3H31169.8°59.9°
H22C2C3H32A60.3°179.9°
C4C3H31H32A118.1°120.0°
C3C4C5H41125.2°120.0°
C3C4C5H42125.3°120.0°
C3C4H41H42117.3°120.0°
C3C4C5N643.4°65.0°
C3C4C5C23159.7°175.0°
C3C4C5H577.8°55.0°
H31C3C4C570.3°60.0°
H31C3C4H41164.4°180.0°
H31C3C4H4255.0°60.0°
H32AC3C4C539.2°60.0°
H32AC3C4H4186.1°60.0°
H32AC3C4H42164.4°180.0°
C5C4H41H42117.3°120.0°
C4C5N6C23114.5°120.0°
C4C5N6H5122.7°120.0°
C4C5C23H5122.5°120.0°
C4C5N6C7127.3°85.0°
C4C5N6HN652.7°95.0°
C4C5C23C2557.8°75.0°
C4C5C23O2493.3°105.0°
H41C4C5N681.9°175.0°
H41C4C5C2334.5°55.1°
H41C4C5H5157.0°65.0°
H42C4C5N6168.6°55.0°
H42C4C5C2375.0°65.0°
H42C4C5H547.5°175.0°
N6C5C23H5121.2°120.0°
C5N6C7HN6180.0°180.0°
C5N6C7O825.6°0.0°
C5N6C7O9153.6°180.0°
N6C5C23C25174.1°165.0°
N6C5C23O2423.0°15.0°
C23C5N6C7118.2°155.0°
C23C5N6HN661.8°25.0°
C5C23C25O2649.1°0.0°
C5C23C25N27127.0°180.0°
C5C23C25O24151.6°180.0°
H5C5N6C74.6°35.0°
H5C5N6HN6175.4°145.0°
H5C5C23C2564.8°45.0°
H5C5C23O24144.2°135.0°
N6C7O8O9179.2°180.0°
N6C7O9C10174.2°180.0°
HN6N6C7O8154.4°180.0°
HN6N6C7O926.4°0.0°
O8C7O9C106.6°0.0°
C7O9C10C11154.6°180.0°
C7O9C10H10180.1°60.0°
C7O9C10H10229.4°60.0°
O9C10C11H101125.3°120.0°
O9C10C11H102125.3°120.0°
O9C10H101H102119.0°120.0°
O9C10C11C1263.1°54.2°
O9C10C11C20165.9°174.6°
O9C10C11C2265.0°77.1°
C11C10H101H102119.0°120.0°
C10C11C12C20130.1°131.2°
C10C11C12C22127.3°131.3°
C10C11C20C22113.7°114.6°
C10C11C12C1344.8°64.7°
C10C11C12H12180.4°175.3°
C10C11C12H122170.1°55.3°
C10C11C20C21110.9°140.0°
C10C11C20H20114.4°105.5°
C10C11C20H202123.9°25.4°
C10C11C22C21111.9°140.0°
C10C11C22H221122.9°25.4°
C10C11C22H22213.4°105.4°
H101C10C11C12171.6°65.8°
H101C10C11C2040.6°65.4°
H101C10C11C2260.3°162.9°
H102C10C11C1262.1°174.2°
H102C10C11C2068.8°54.6°
H102C10C11C22169.8°42.9°
C12C11C20C22115.7°114.6°
C11C12C13H121125.3°120.0°
C11C12C13H122125.3°119.9°
C11C12H121H122117.9°119.9°
C11C12C13C14108.6°91.0°
C11C12C13C1971.3°89.3°
C12C11C20C21118.5°89.2°
C12C11C20H201116.2°25.4°
C12C11C20H2026.8°156.2°
C12C11C22C21119.6°89.1°
C12C11C22H2215.6°156.3°
C12C11C22H222115.1°25.5°
C20C11C12C1385.3°66.5°
C20C11C12H121149.5°53.5°
C20C11C12H12240.0°173.5°
C11C20C21H201125.3°114.5°
C11C20C21H202125.2°114.6°
C11C20H201H202125.5°131.2°
C20C11C22C212.8°25.4°
C11C20C21H211122.5°89.1°
C11C20C21H212128.0°140.0°
C20C11C22H221122.5°89.1°
C20C11C22H222128.0°140.0°
C22C11C12C13172.2°164.0°
C22C11C12H12146.9°44.0°
C22C11C12H12262.6°76.0°
C22C11C20H201128.1°140.0°
C22C11C20H202122.5°89.2°
C11C22C21H221125.3°114.5°
C11C22C21H222125.3°114.5°
C11C22C21H211122.5°89.1°
C11C22C21H212128.0°140.0°
C11C22H221H222125.6°131.2°
C13C12H121H122117.9°120.1°
C12C13C14C19179.9°179.7°
C12C13C14C15179.8°180.0°
C12C13C14H140.2°0.0°
C12C13C19C18179.8°179.7°
C12C13C19H190.2°0.2°
H121C12C13C1416.6°29.0°
H121C12C13C19163.5°150.8°
H122C12C13C14126.1°149.0°
H122C12C13C1954.0°30.7°
C13C14C15H14180.0°179.9°
C13C14C15C160.1°0.0°
C13C14C15H15179.9°179.9°
C14C13C19C180.1°0.5°
C14C13C19H19179.8°179.9°
C19C13C14C150.1°0.3°
C19C13C14H14179.9°179.8°
C13C19C18C160.0°0.5°
C13C19C18H19180.0°179.6°
C13C19C18H18179.9°179.8°
C14C15C16H15180.0°179.9°
C14C15C16F17179.8°180.0°
C14C15C16C180.2°0.0°
H14C14C15C16179.9°179.9°
H14C14C15H150.1°0.0°
C15C16F17C18180.0°179.9°
C15C16C18C190.2°0.2°
C15C16C18H18179.8°179.9°
H15C15C16F170.2°0.1°
H15C15C16C18179.8°180.0°
F17C16C18C19179.8°179.7°
F17C16C18H180.2°0.0°
C16C18C19H18180.0°179.7°
C16C18C19H19180.0°179.9°
H18C18C19H190.0°0.2°
C21C20H201H202125.5°131.2°
C20C21C22H211125.3°114.6°
C20C21C22H212125.3°114.5°
C20C21H211H212125.3°131.2°
C20C21C22H221122.5°89.1°
C20C21C22H222128.0°140.0°
H201C20C21C22128.0°140.0°
H201C20C21H2112.8°25.4°
H201C20C21H212106.7°105.5°
H202C20C21C22122.5°89.2°
H202C20C21H211112.2°156.3°
H202C20C21H2122.8°25.4°
C22C21H211H212125.3°131.3°
C21C22H221H222125.6°131.3°
H211C21C22H221112.2°156.3°
H211C21C22H2222.8°25.4°
H212C21C22H2212.8°25.5°
H212C21C22H222106.7°105.5°
O26C25N27C23176.1°180.0°
O26C25N27C283.2°0.0°
O26C25N27H27176.8°180.0°
O26C25C23O24159.3°180.0°
C25N27C28H27180.0°179.9°
C25N27C28C2966.9°0.3°
C25N27C28N32113.6°180.0°
N27C25C23O2424.6°0.0°
C23C25N27C28172.9°180.0°
C23C25N27H277.1°0.0°
N27C28C29N32179.5°179.8°
N27C28C29C30179.7°179.9°
N27C28C29H290.3°0.3°
N27C28N32N31179.7°180.0°
N27C28N32H320.3°0.0°
H27N27C28C29113.1°179.7°
H27N27C28N3266.4°0.0°
C28C29C30H29180.0°179.6°
C28C29C30N310.0°0.4°
C28C29C30H30180.0°179.8°
C29C28N32N310.2°0.2°
C29C28N32H32179.8°179.8°
N32C28C29C300.1°0.4°
N32C28C29H29179.9°180.0°
C28N32N31C300.2°0.0°
C28N32N31H32180.0°180.0°
C29C30N31H30180.0°179.8°
C29C30N31N320.1°0.2°
H29C29C30N31180.0°180.0°
H29C29C30H300.0°0.2°
C30N31N32H32179.8°180.0°
H30C30N31N32179.9°180.0°

219140

PDB entries from 2024-05-01

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