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FL1

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
S1O1doub1.42Å1.45Å
S1O2doub1.42Å1.44Å
S1N1sing1.66Å1.61Å
S1C1sing1.76Å1.78Å
N1HN11sing0.97Å1.00Å
N1HN12sing0.97Å1.00Å
C1C2doub1.38Å1.41ÅAromatic
C1C6sing1.38Å1.43ÅAromatic
C2C3sing1.38Å1.37ÅAromatic
C2H2sing1.08Å1.08Å
C3C4doub1.38Å1.42ÅAromatic
C3H3sing1.08Å1.08Å
C4C5sing1.38Å1.42ÅAromatic
C4C7sing1.51Å1.54Å
C5C6doub1.38Å1.38ÅAromatic
C5H5sing1.08Å1.08Å
C6H6sing1.08Å1.08Å
C7C29sing1.53Å1.53Å
C7H71sing1.09Å1.10Å
C7H72sing1.09Å1.10Å
C29N2sing1.47Å1.44Å
C29H291sing1.09Å1.10Å
C29H292sing1.09Å1.10Å
N2C8sing1.35Å1.32Å
N2HN2sing0.97Å1.00Å
C8S2doub1.71Å1.69Å
C8N3sing1.35Å1.36Å
N3C9sing1.39Å1.42Å
N3HN3sing0.97Å1.00Å
C9C10sing1.39Å1.41ÅAromatic
C9C14doub1.39Å1.41ÅAromatic
C10C11doub1.38Å1.40ÅAromatic
C10H10sing1.08Å1.08Å
C11C12sing1.40Å1.43ÅAromatic
C11H11sing1.08Å1.08Å
C12C13doub1.41Å1.45ÅAromatic
C12C16sing1.47Å1.54ÅAromatic
C13C14sing1.39Å1.41ÅAromatic
C13C15sing1.48Å1.53Å
C14H14sing1.08Å1.08Å
C15O3doub1.35Å1.26Å
C15O4sing1.21Å1.25Å
O4HO4sing4.35Å0.95Å
C16C25sing1.41Å1.43ÅAromatic
C16C27doub1.47Å1.46ÅAromatic
C17C18doub1.36Å1.38ÅAromatic
C17C27sing1.40Å1.46ÅAromatic
C17H17sing1.08Å1.08Å
C18C19sing1.40Å1.45ÅAromatic
C18H18sing1.08Å1.08Å
C19C20sing1.39Å1.44ÅAromatic
C19O6doub1.36Å1.32Å
C20C28doub1.39Å1.39ÅAromatic
C20H20sing1.08Å1.08Å
C21C22doub1.40Å1.44ÅAromatic
C21C26sing1.38Å1.39ÅAromatic
C21H21sing1.08Å1.08Å
C22C23sing1.41Å1.47ÅAromatic
C22O7sing1.23Å1.28Å
C23C24doub1.36Å1.37ÅAromatic
C23H23sing1.08Å1.08Å
C24C25sing1.41Å1.47ÅAromatic
C24H24sing1.08Å1.08Å
C25C26doub1.41Å1.45ÅAromatic
C26O5sing1.35Å1.39ÅAromatic
C27C28sing1.41Å1.45ÅAromatic
C28O5sing1.35Å1.39ÅAromatic
O7HO7sing9.15Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
O1S1O2118.2°125.4°
O1S1N1107.5°105.8°
O1S1C1107.2°105.8°
O2S1N1109.0°105.8°
O2S1C1107.1°105.7°
N1S1C1107.4°107.4°
S1N1HN11109.5°120.0°
S1N1HN12109.5°120.0°
S1C1C2118.3°120.0°
S1C1C6120.2°120.0°
HN11N1HN12109.5°120.0°
C2C1C6121.5°120.0°
C1C2C3118.4°120.0°
C1C2H2120.8°120.0°
C1C6C5118.4°120.0°
C1C6H6120.8°120.0°
C3C2H2120.8°120.0°
C2C3C4122.5°120.0°
C2C3H3118.8°120.1°
C4C3H3118.8°120.0°
C3C4C5118.0°120.0°
C3C4C7121.0°120.0°
C5C4C7121.1°120.0°
C4C5C6121.4°120.0°
C4C5H5119.4°120.0°
C4C7C29113.5°109.5°
C4C7H71107.2°109.5°
C4C7H72108.1°109.5°
C6C5H5119.3°120.0°
C5C6H6120.8°120.1°
C29C7H71107.2°109.5°
C29C7H72108.1°109.5°
C7C29N2111.8°109.5°
C7C29H291108.2°109.5°
C7C29H292108.7°109.5°
H71C7H72112.7°109.4°
N2C29H291108.2°109.4°
N2C29H292108.7°109.5°
C29N2C8124.9°120.0°
C29N2HN2117.5°120.0°
H291C29H292111.3°109.5°
C8N2HN2117.6°120.0°
N2C8S2122.7°120.0°
N2C8N3113.9°120.0°
S2C8N3123.4°120.0°
C8N3C9135.9°120.0°
C8N3HN3112.1°119.9°
C9N3HN3112.0°120.1°
N3C9C10120.3°119.8°
N3C9C14120.1°119.9°
C10C9C14119.6°120.3°
C9C10C11120.5°120.4°
C9C10H10119.7°119.8°
C9C14C13122.0°119.9°
C9C14H14119.0°120.0°
C11C10H10119.7°119.8°
C10C11C12120.4°120.0°
C10C11H11119.8°120.0°
C12C11H11119.8°120.0°
C11C12C13119.1°119.7°
C11C12C16116.3°120.1°
C13C12C16124.5°120.2°
C12C13C14118.3°119.6°
C12C13C15123.5°120.2°
C12C16C25120.0°121.2°
C12C16C27121.0°121.2°
C14C13C15118.2°120.2°
C13C14H14119.0°120.0°
C13C15O3117.7°120.0°
C13C15O4118.2°120.0°
O3C15O4124.0°120.0°
C15O4HO4109.5°20.0°
C25C16C27119.0°117.6°
C16C25C24124.8°120.3°
C16C25C26119.5°119.4°
C16C27C17126.0°120.8°
C16C27C28119.3°119.0°
C18C17C27122.1°119.8°
C18C17H17118.9°120.2°
C17C18C19122.0°120.4°
C17C18H18119.0°119.8°
C27C17H17118.9°120.1°
C17C27C28114.7°120.2°
C19C18H18119.0°119.8°
C18C19C20117.1°120.6°
C18C19O6120.2°119.7°
C20C19O6122.7°119.7°
C19C20C28120.4°119.9°
C19C20H20119.8°120.0°
C28C20H20119.8°120.1°
C20C28C27123.7°119.2°
C20C28O5116.3°120.4°
C22C21C26119.9°120.0°
C22C21H21120.0°120.0°
C21C22C23118.5°120.3°
C21C22O7121.8°119.8°
C26C21H21120.1°120.0°
C21C26C25123.1°119.2°
C21C26O5116.4°119.7°
C23C22O7119.7°119.9°
C22C23C24120.7°120.2°
C22C23H23119.7°119.9°
C22O7HO7109.5°24.8°
C24C23H23119.7°119.9°
C23C24C25122.1°120.0°
C23C24H24119.0°120.0°
C25C24H24119.0°120.0°
C24C25C26115.7°120.3°
C25C26O5120.5°121.1°
C26O5C28121.8°122.5°
C27C28O5120.1°120.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
O1S1O2N1123.1°123.1°
O1S1O2C1121.0°123.1°
O1S1N1C1115.1°112.6°
O1S1N1HN1127.2°7.4°
O1S1N1HN12147.2°172.3°
O1S1C1C269.9°22.6°
O1S1C1C6110.0°157.1°
O2S1N1C1115.7°112.6°
O2S1N1HN11156.5°127.4°
O2S1N1HN1283.5°52.9°
O2S1C1C2162.3°157.4°
O2S1C1C617.8°22.3°
S1N1HN11HN12120.0°179.7°
N1S1C1C245.4°90.0°
N1S1C1C6134.7°90.3°
C1S1N1HN1187.9°120.0°
C1S1N1HN1232.2°59.7°
S1C1C2C6179.9°179.7°
S1C1C2C3179.9°180.0°
S1C1C2H20.0°0.1°
S1C1C6C5180.0°179.8°
S1C1C6H60.0°0.2°
C1C2C3H2180.0°179.9°
C1C2C3C40.0°0.1°
C1C2C3H3180.0°180.0°
C2C1C6C50.1°0.5°
C2C1C6H6179.9°179.9°
C6C1C2C30.0°0.3°
C6C1C2H2179.9°179.8°
C1C6C5C40.0°0.4°
C1C6C5H6180.0°179.6°
C1C6C5H5180.0°179.8°
C2C3C4H3180.0°180.0°
C2C3C4C50.0°0.0°
C2C3C4C7179.8°180.0°
H2C2C3C4180.0°180.0°
H2C2C3H30.0°0.1°
C3C4C5C7179.8°179.9°
C3C4C5C60.0°0.1°
C3C4C5H5180.0°179.9°
C3C4C7C2915.1°90.0°
C3C4C7H71133.3°150.0°
C3C4C7H72105.0°30.1°
H3C3C4C5180.0°179.9°
H3C3C4C70.2°0.0°
C4C5C6H5180.0°179.8°
C4C5C6H6180.0°180.0°
C5C4C7C29165.1°89.9°
C5C4C7H7146.9°30.1°
C5C4C7H7274.9°150.0°
C7C4C5C6179.8°179.8°
C7C4C5H50.2°0.0°
C4C7C29H71118.2°120.0°
C4C7C29H72120.0°120.0°
C4C7H71H72118.8°120.0°
C4C7C29N2172.0°180.0°
C4C7C29H29169.0°60.0°
C4C7C29H29252.0°60.0°
H5C5C6H60.1°0.2°
C29C7H71H72118.9°120.0°
C7C29N2H291119.0°120.0°
C7C29N2H292120.0°120.0°
C7C29H291H292119.4°120.0°
C7C29N2C865.4°180.0°
C7C29N2HN2114.6°0.1°
H71C7C29N253.8°60.0°
H71C7C29H291172.8°180.0°
H71C7C29H29266.2°60.0°
H72C7C29N268.0°60.0°
H72C7C29H29151.0°60.0°
H72C7C29H292172.0°180.0°
N2C29H291H292119.3°120.0°
C29N2C8HN2180.0°179.9°
C29N2C8S233.0°0.0°
C29N2C8N3147.3°179.9°
H291C29N2C8175.5°60.0°
H291C29N2HN24.4°120.1°
H292C29N2C854.6°60.0°
H292C29N2HN2125.4°119.9°
N2C8S2N3179.7°180.0°
N2C8N3C9179.8°174.2°
N2C8N3HN30.2°5.8°
HN2N2C8S2147.0°179.9°
HN2N2C8N332.7°0.1°
S2C8N3C90.5°5.8°
S2C8N3HN3179.5°174.2°
C8N3C9HN3180.0°180.0°
C8N3C9C107.3°138.2°
C8N3C9C14172.8°42.1°
N3C9C10C14179.9°179.7°
N3C9C10C11179.7°180.0°
N3C9C10H100.3°0.0°
N3C9C14C13179.7°179.7°
N3C9C14H140.3°0.3°
HN3N3C9C10172.7°41.8°
HN3N3C9C147.2°137.8°
C9C10C11H10180.0°180.0°
C9C10C11C120.0°0.1°
C9C10C11H11180.0°179.9°
C10C9C14C130.2°0.6°
C10C9C14H14179.9°180.0°
C14C9C10C110.2°0.3°
C14C9C10H10179.8°179.7°
C9C14C13C120.0°0.5°
C9C14C13H14180.0°179.4°
C9C14C13C15179.9°179.7°
C10C11C12H11180.0°179.8°
C10C11C12C130.2°0.1°
C10C11C12C16179.8°179.9°
H10C10C11C12180.0°180.0°
H10C10C11H110.0°0.1°
C11C12C13C16180.0°179.9°
C11C12C13C140.2°0.2°
C11C12C13C15179.7°180.0°
C11C12C16C25107.0°105.0°
C11C12C16C2773.4°75.4°
H11C11C12C13179.8°180.0°
H11C11C12C160.2°0.1°
C12C13C14C15179.9°179.8°
C12C13C14H14179.9°179.9°
C12C13C15O353.5°180.0°
C12C13C15O4126.1°0.1°
C13C12C16C2573.0°74.9°
C13C12C16C27106.6°104.7°
C16C12C13C14179.8°179.7°
C16C12C13C150.3°0.1°
C12C16C25C27179.5°179.6°
C12C16C27C170.5°0.7°
C12C16C25C240.6°0.1°
C12C16C25C26179.8°180.0°
C12C16C27C28179.9°179.8°
C14C13C15O3126.6°0.2°
C14C13C15O453.9°179.7°
C15C13C14H140.1°0.2°
C13C15O3O4179.5°179.9°
C13C15O4HO4179.6°57.4°
O3C15O4HO40.0°122.6°
C25C16C27C17180.0°179.7°
C16C25C26C21179.8°179.9°
C16C25C24C23179.9°179.9°
C16C25C24C26179.6°179.9°
C16C25C24H240.1°0.1°
C16C25C26O50.3°0.1°
C25C16C27C280.4°0.5°
C16C27C17C18179.7°179.8°
C16C27C17C28179.6°179.2°
C16C27C17H170.3°0.5°
C16C27C28C20179.9°179.7°
C27C16C25C24179.9°179.8°
C27C16C25C260.3°0.3°
C16C27C28O50.5°0.5°
C18C17C27H17180.0°179.7°
C17C18C19H18180.0°179.9°
C17C18C19C200.1°0.1°
C17C18C19O6179.9°180.0°
C18C17C27C280.1°0.6°
C27C17C18C190.1°0.4°
C27C17C18H18179.9°179.7°
C17C27C28C200.3°0.5°
C17C27C28O5179.9°179.7°
H17C17C18C19180.0°179.9°
H17C17C18H180.1°0.0°
H17C17C27C28179.9°179.7°
C18C19C20O6179.8°179.9°
C18C19C20C280.2°0.0°
C18C19C20H20179.8°179.9°
H18C18C19C20179.9°180.0°
H18C18C19O60.1°0.1°
C19C20C28H20180.0°180.0°
C19C20C28C270.3°0.3°
C19C20C28O5179.9°180.0°
O6C19C20C28180.0°179.9°
O6C19C20H200.0°0.0°
C20C28O5C26179.8°180.0°
C20C28C27O5179.6°179.8°
H20C20C28C27179.7°179.7°
H20C20C28O50.1°0.0°
C22C21C26H21180.0°180.0°
C21C22C23O7179.9°180.0°
C21C22C23C240.0°0.0°
C21C22C23H23179.9°179.9°
C22C21C26C250.3°0.0°
C22C21C26O5179.9°180.0°
C21C22O7HO787.5°149.4°
C26C21C22C230.0°0.0°
C26C21C22O7179.9°180.0°
C21C26C25C240.5°0.0°
C21C26C25O5179.6°180.0°
C21C26O5C28180.0°180.0°
H21C21C22C23180.0°180.0°
H21C21C22O70.1°0.0°
H21C21C26C25179.7°180.0°
H21C21C26O50.1°0.0°
C22C23C24H23180.0°179.9°
C22C23C24C250.2°0.0°
C22C23C24H24179.8°180.0°
C23C22O7HO792.6°30.6°
O7C22C23C24179.9°180.0°
O7C22C23H230.1°0.0°
C23C24C25H24180.0°180.0°
C23C24C25C260.5°0.0°
H23C23C24C25179.8°179.9°
H23C23C24H240.2°0.0°
C24C25C26O5179.9°180.0°
H24C24C25C26179.5°180.0°
C25C26O5C280.4°0.0°
C26O5C28C270.5°0.3°

226262

PDB entries from 2024-10-16

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