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Q5Y

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
O4S1doub1.42Å1.45Å
S1O5doub1.42Å1.44Å
S1C9sing1.76Å1.84Å
S1N1sing1.66Å1.71Å
O2C8doub1.21Å1.28Å
C14C13doub1.38Å1.39ÅAromatic
C14C9sing1.38Å1.40ÅAromatic
C7C8sing1.51Å1.55Å
C7N1sing1.47Å1.48Å
C13C12sing1.39Å1.41ÅAromatic
C9C10doub1.38Å1.39ÅAromatic
C8O1sing1.34Å1.27Å
N1C4sing1.40Å1.44Å
C12O3sing1.36Å1.41Å
C12C11doub1.39Å1.41ÅAromatic
C10C11sing1.38Å1.38ÅAromatic
C16C17doub1.36Å1.38ÅAromatic
C16C3sing1.40Å1.40ÅAromatic
O3C15sing1.43Å1.41Å
C4C3doub1.41Å1.42ÅAromatic
C4C5sing1.38Å1.38ÅAromatic
C17C18sing1.39Å1.40ÅAromatic
C3C2sing1.42Å1.36ÅAromatic
C5C6doub1.39Å1.39ÅAromatic
C18C19doub1.36Å1.37ÅAromatic
C2C19sing1.40Å1.41ÅAromatic
C2C1doub1.41Å1.40ÅAromatic
C6C1sing1.38Å1.38ÅAromatic
C1N2sing1.40Å1.43Å
C22C21doub1.38Å1.40ÅAromatic
C22C23sing1.39Å1.41ÅAromatic
C21C20sing1.38Å1.40ÅAromatic
N2S2sing1.66Å1.67Å
C26O6sing1.43Å1.40Å
O6C23sing1.36Å1.40Å
C23C24doub1.39Å1.37ÅAromatic
C20S2sing1.76Å1.82Å
C20C25doub1.38Å1.39ÅAromatic
S2O7doub1.42Å1.46Å
S2O8doub1.42Å1.50Å
C24C25sing1.38Å1.38ÅAromatic
O1H1sing0.97Å0.95Å
C7H2sing1.09Å1.10Å
C7H3sing1.09Å1.10Å
C5H4sing1.08Å1.08Å
C6H5sing1.08Å1.08Å
N2H6sing0.97Å1.00Å
C21H7sing1.08Å1.08Å
C22H8sing1.08Å1.08Å
C26H9sing1.09Å1.10Å
C26H10sing1.09Å1.10Å
C26H11sing1.09Å1.10Å
C24H12sing1.08Å1.08Å
C25H13sing1.08Å1.08Å
C16H14sing1.08Å1.08Å
C17H15sing1.08Å1.08Å
C18H16sing1.08Å1.08Å
C19H17sing1.08Å1.08Å
C10H18sing1.08Å1.08Å
C11H19sing1.08Å1.08Å
C15H20sing1.09Å1.10Å
C15H21sing1.09Å1.10Å
C15H22sing1.09Å1.10Å
C13H23sing1.08Å1.08Å
C14H24sing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
O4S1O5112.8°123.1°
O4S1C9112.6°106.4°
O4S1N1105.6°106.4°
O5S1C9106.5°106.4°
O5S1N1120.3°106.4°
C9S1N198.3°107.2°
S1C9C14122.2°119.9°
S1C9C10117.6°119.9°
S1N1C7119.0°120.0°
S1N1C4129.2°120.0°
O2C8C7120.0°120.0°
O2C8O1120.0°120.0°
C13C14C9120.2°120.0°
C14C13C12119.4°119.9°
C14C13H23120.3°120.0°
C13C14H24119.9°119.9°
C14C9C10120.1°120.1°
C9C14H24119.9°120.0°
C8C7N1121.0°109.5°
C7C8O1119.8°120.0°
C8C7H2106.5°109.5°
C8C7H3106.5°109.5°
C7N1C4111.8°120.0°
N1C7H2106.5°109.5°
N1C7H3106.5°109.4°
C13C12O3119.2°120.0°
C13C12C11120.1°119.9°
C12C13H23120.3°120.1°
C9C10C11120.4°120.0°
C9C10H18119.8°120.0°
C8O1H1109.5°117.0°
N1C4C3118.7°120.1°
N1C4C5119.7°120.1°
O3C12C11120.8°120.0°
C12O3C15115.7°117.0°
C12C11C10119.8°119.9°
C12C11H19120.1°120.1°
C11C10H18119.8°120.0°
C10C11H19120.1°120.0°
C17C16C3120.2°119.7°
C16C17C18120.2°120.9°
C17C16H14119.9°120.2°
C16C17H15119.9°119.6°
C16C3C4121.4°121.2°
C16C3C2119.2°119.3°
C3C16H14119.9°120.1°
O3C15H20109.5°109.5°
O3C15H21109.5°109.5°
O3C15H22109.4°109.5°
C3C4C5121.2°119.7°
C4C3C2119.3°119.5°
C4C5C6118.7°120.8°
C4C5H4120.6°119.6°
C17C18C19119.5°121.0°
C18C17H15119.9°119.5°
C17C18H16120.2°119.5°
C3C2C19120.8°119.4°
C3C2C1119.3°119.4°
C5C6C1119.9°120.8°
C6C5H4120.6°119.6°
C5C6H5120.1°119.6°
C18C19C2120.0°119.7°
C19C18H16120.2°119.5°
C18C19H17120.0°120.2°
C19C2C1119.9°121.2°
C2C19H17120.0°120.2°
C2C1C6121.6°119.7°
C2C1N2116.2°120.1°
C6C1N2122.1°120.1°
C1C6H5120.1°119.6°
C1N2S2126.2°120.0°
C1N2H6105.1°120.0°
C21C22C23120.7°119.9°
C22C21C20117.8°120.1°
C22C21H7121.1°120.0°
C21C22H8119.6°120.0°
C22C23O6124.9°120.1°
C22C23C24120.1°119.9°
C23C22H8119.6°120.1°
C21C20S2124.1°120.0°
C21C20C25120.6°120.0°
C20C21H7121.1°119.9°
N2S2C20110.2°107.2°
N2S2O7114.3°106.4°
N2S2O899.1°106.4°
S2N2H6105.1°120.0°
C26O6C23119.0°117.0°
O6C26H9109.5°109.5°
O6C26H10109.5°109.5°
O6C26H11109.5°109.5°
O6C23C24115.0°120.0°
C23C24C25119.6°120.0°
C23C24H12120.2°120.0°
S2C20C25115.3°120.0°
C20S2O7108.4°106.4°
C20S2O8114.8°106.4°
C20C25C24121.1°120.0°
C20C25H13119.4°119.9°
O7S2O8109.9°123.2°
C25C24H12120.2°120.0°
C24C25H13119.4°120.1°
H2C7H3109.4°109.4°
H9C26H10109.5°109.4°
H9C26H11109.5°109.4°
H10C26H11109.4°109.5°
H20C15H21109.4°109.5°
H20C15H22109.5°109.4°
H21C15H22109.5°109.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
O4S1O5C9124.0°122.9°
O4S1O5N1125.7°123.0°
O4S1C9N1110.8°113.6°
O4S1C9C1420.6°156.2°
O4S1N1C76.2°23.6°
O4S1C9C10162.1°23.6°
O4S1N1C4173.0°156.4°
O5S1C9N1125.1°113.5°
O5S1C9C14144.7°23.3°
O5S1N1C7135.1°156.5°
O5S1C9C1038.0°156.5°
O5S1N1C444.0°23.5°
S1C9C14C13179.6°179.7°
S1C9C14C10177.2°179.8°
C9S1N1C7110.2°90.0°
C9S1N1C470.6°90.0°
S1C9C10C11178.8°180.0°
S1C9C10H181.2°0.1°
S1C9C14H240.4°0.2°
N1S1C9C1490.2°90.2°
S1N1C7C8110.1°95.0°
S1N1C7C4179.3°180.0°
N1S1C9C1087.1°90.0°
S1N1C4C388.4°85.0°
S1N1C4C599.5°94.7°
S1N1C7H2128.3°145.0°
S1N1C7H311.5°25.0°
O2C8C7O1176.2°180.0°
O2C8C7N183.3°0.0°
O2C8O1H10.0°0.0°
O2C8C7H2155.0°120.0°
O2C8C7H338.3°120.0°
C13C14C9H24180.0°179.4°
C14C13C12H23180.0°179.7°
C13C14C9C102.3°0.5°
C14C13C12O3178.9°179.7°
C14C13C12C110.4°0.3°
C9C14C13C121.8°0.6°
C14C9C10C111.4°0.2°
C14C9C10H18178.6°179.7°
C9C14C13H23178.2°179.7°
C8C7N1H2121.6°120.1°
C8C7N1H3121.6°120.0°
C8C7N1C470.6°85.0°
C7C8O1H1176.2°180.0°
C8C7H2H3114.8°120.0°
N1C7C8O1100.5°180.0°
C7N1C4C390.8°95.0°
C7N1C4C581.3°85.3°
N1C7H2H3114.8°119.9°
C13C12O3C11179.3°179.9°
C13C12C11C100.5°0.0°
C13C12O3C15147.9°0.1°
C13C12C11H19179.5°180.0°
C12C13C14H24178.2°180.0°
C9C10C11C120.0°0.1°
C9C10C11H18180.0°179.9°
C9C10C11H19180.0°180.0°
C10C9C14H24177.7°180.0°
O1C8C7H221.2°59.9°
O1C8C7H3137.9°60.1°
N1C4C3C166.7°0.1°
N1C4C3C5172.0°179.7°
N1C4C3C2175.9°179.7°
N1C4C5C6175.8°180.0°
C4N1C7H251.1°35.1°
C4N1C7H3167.8°155.0°
N1C4C5H44.2°0.1°
O3C12C11C10179.8°179.9°
O3C12C11H190.2°0.0°
C12O3C15H20180.0°60.0°
C12O3C15H2160.0°60.1°
C12O3C15H2260.0°180.0°
O3C12C13H231.1°0.1°
C12C11C10H19180.0°180.0°
C11C12O3C1531.4°180.0°
C12C11C10H18180.0°180.0°
C11C12C13H23179.6°180.0°
C17C16C3H14180.0°179.9°
C17C16C3C4178.1°180.0°
C16C17C18H15180.0°180.0°
C17C16C3C20.7°0.3°
C16C17C18C190.7°0.6°
C16C17C18H16179.3°180.0°
C16C3C4C2177.4°179.7°
C16C3C4C5178.7°179.8°
C3C16C17C180.2°0.0°
C16C3C2C191.0°0.0°
C16C3C2C1179.0°179.8°
C3C16C17H15179.8°180.0°
O3C15H20H21120.0°120.1°
O3C15H20H22120.0°120.0°
O3C15H21H22120.0°120.0°
C3C4C5C63.9°0.3°
C4C3C2C19178.5°179.7°
C4C3C2C11.6°0.5°
C3C4C5H4176.1°179.8°
C4C3C16H141.9°0.1°
C5C4C3C23.9°0.6°
C4C5C6H4180.0°179.9°
C4C5C6C11.6°0.0°
C4C5C6H5178.4°179.9°
C17C18C19H16180.0°179.4°
C17C18C19C20.3°0.9°
C18C17C16H14179.8°179.9°
C17C18C19H17179.7°180.0°
C3C2C19C180.5°0.6°
C3C2C19C1179.9°179.8°
C3C2C1C60.7°0.2°
C3C2C1N2176.8°179.7°
C2C3C16H14179.3°179.8°
C3C2C19H17179.5°179.7°
C5C6C1C20.7°0.0°
C5C6C1H5180.0°180.0°
C5C6C1N2176.6°180.0°
C18C19C2H17180.0°179.2°
C18C19C2C1179.5°179.2°
C19C18C17H15179.3°179.4°
C19C2C1C6179.3°180.0°
C19C2C1N23.1°0.1°
C2C19C18H16179.7°179.7°
C2C1C6N2175.9°179.9°
C2C1N2S2106.4°144.4°
C2C1C6H5179.3°180.0°
C2C1N2H6131.4°35.5°
C1C2C19H170.5°0.0°
C6C1N2S277.5°35.6°
C1C6C5H4178.4°179.9°
C6C1N2H644.7°144.5°
C1N2S2H6122.2°179.9°
C1N2S2C2034.3°60.3°
C1N2S2O788.1°53.2°
C1N2S2O8155.1°173.9°
N2C1C6H53.4°0.1°
C21C22C23H8180.0°180.0°
C22C21C20H7180.0°179.9°
C21C22C23O6179.8°180.0°
C21C22C23C240.6°0.0°
C22C21C20S2179.3°180.0°
C22C21C20C250.6°0.2°
C23C22C21C200.5°0.0°
C22C23O6C26110.3°180.0°
C22C23O6C24179.3°180.0°
C22C23C24C251.6°0.2°
C23C22C21H7179.5°179.9°
C22C23C24H12178.4°180.0°
C21C20S2N268.3°89.8°
C21C20S2C25179.9°179.8°
C21C20S2O757.5°23.8°
C21C20S2O8179.2°156.7°
C21C20C25C240.4°0.5°
C20C21C22H8179.5°180.0°
C21C20C25H13179.6°179.7°
N2S2C20O7125.8°113.5°
N2S2C20O8110.9°113.5°
N2S2C20C25111.6°90.0°
N2S2O7O8110.4°122.9°
C26O6C23C2470.5°0.0°
O6C26H9H10120.0°120.0°
O6C26H9H11120.0°120.0°
O6C26H10H11120.0°120.1°
O6C23C24C25179.1°179.7°
O6C23C22H80.2°0.0°
C23O6C26H9180.0°180.0°
C23O6C26H1060.0°60.0°
C23O6C26H1160.0°60.0°
O6C23C24H120.9°0.0°
C23C24C25C201.5°0.5°
C23C24C25H12180.0°179.8°
C24C23C22H8179.5°180.0°
C23C24C25H13178.5°179.7°
C20S2O7O8126.2°123.0°
S2C20C25C24179.7°179.8°
C20S2N2H687.9°119.6°
S2C20C21H70.7°0.1°
S2C20C25H130.3°0.0°
C25C20S2O7122.6°156.4°
C25C20S2O80.7°23.5°
C20C25C24H13180.0°179.8°
C25C20C21H7179.4°179.7°
C20C25C24H12178.5°179.7°
O7S2N2H6149.7°126.9°
O8S2N2H632.8°6.1°
H4C5C6H51.6°0.0°
H7C21C22H80.5°0.1°
H9C26H10H11120.0°120.0°
H12C24C25H131.5°0.0°
H14C16C17H150.2°0.1°
H15C17C18H160.7°0.0°
H16C18C19H170.3°0.6°
H18C10C11H190.0°0.1°
H20C15H21H22120.0°119.9°
H23C13C14H241.8°0.3°

222624

PDB entries from 2024-07-17

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