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0PL

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
H1C1sing1.09Å1.10Å
H1AC1sing1.09Å1.10Å
C1H1Bsing1.09Å1.10Å
C1N2sing1.47Å1.47Å
C3N2sing1.47Å1.47Å
N2S27sing1.66Å1.63Å
H3C3sing1.09Å1.10Å
C4C3sing1.51Å1.51Å
C3H3Asing1.09Å1.10Å
C5C4doub1.38Å1.39ÅAromatic
C4C9sing1.38Å1.39ÅAromatic
C6C5sing1.38Å1.39ÅAromatic
H5C5sing1.08Å1.08Å
C11C6sing1.51Å1.52Å
C6C7doub1.38Å1.39ÅAromatic
H7C7sing1.08Å1.08Å
C7C8sing1.38Å1.38ÅAromatic
C8H8sing1.08Å1.08Å
C8C9doub1.38Å1.38ÅAromatic
C9CL1sing1.74Å1.73Å
C13C11sing1.53Å1.53Å
C17C11sing1.51Å1.52Å
H11C11sing1.09Å1.10Å
C14C13sing1.51Å1.52Å
C13H13sing1.09Å1.10Å
C13H13Asing1.09Å1.10Å
O15C14doub1.21Å1.25Å
O16C14sing1.34Å1.25Å
O16HO16sing0.97Å0.95Å
C18C17doub1.39Å1.40ÅAromatic
C17C26sing1.36Å1.40ÅAromatic
C19C18sing1.38Å1.39ÅAromatic
H18C18sing1.08Å1.08Å
H19C19sing1.08Å1.08Å
C19C20doub1.39Å1.40ÅAromatic
N21C20sing1.37Å1.36ÅAromatic
C20C25sing1.40Å1.39ÅAromatic
C22N21sing1.46Å1.46Å
N21N23sing1.40Å1.36ÅAromatic
H22C22sing1.09Å1.10Å
H22BC22sing1.09Å1.10Å
C22H22Asing1.09Å1.10Å
N23N24doub1.29Å1.32ÅAromatic
C25N24sing1.35Å1.36ÅAromatic
C25C26doub1.40Å1.41ÅAromatic
C26H26sing1.08Å1.08Å
C30S27sing1.76Å1.76Å
S27O28doub1.42Å1.43Å
S27O29doub1.42Å1.43Å
C35C30doub1.38Å1.38ÅAromatic
C31C30sing1.38Å1.38ÅAromatic
C32C31doub1.38Å1.38ÅAromatic
C31H31sing1.08Å1.08Å
C33C32sing1.38Å1.38ÅAromatic
H32C32sing1.08Å1.08Å
H33C33sing1.08Å1.08Å
C33C34doub1.38Å1.38ÅAromatic
H34C34sing1.08Å1.08Å
C34C35sing1.38Å1.38ÅAromatic
C35H35sing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
H1C1H1A109.5°109.5°
H1C1H1B109.5°109.4°
H1C1N2109.5°109.4°
H1AC1H1B109.5°109.5°
H1AC1N2109.4°109.4°
H1BC1N2109.5°109.5°
C1N2C3114.0°120.0°
C1N2S27116.5°120.0°
C3N2S27117.9°120.0°
N2C3H3108.7°109.4°
N2C3C4112.5°109.5°
N2C3H3A108.7°109.4°
N2S27C30104.6°107.2°
N2S27O28106.8°106.4°
N2S27O29107.5°106.4°
H3C3C4108.7°109.5°
H3C3H3A109.5°109.5°
C4C3H3A108.7°109.5°
C3C4C5120.0°120.0°
C3C4C9121.5°120.0°
C5C4C9118.4°120.0°
C4C5C6121.6°120.0°
C4C5H5119.2°120.0°
C4C9C8120.8°120.0°
C4C9CL1120.2°120.0°
C6C5H5119.2°120.0°
C5C6C11121.6°120.0°
C5C6C7118.5°120.1°
C11C6C7119.9°120.0°
C6C11C13112.0°109.5°
C6C11C17110.8°109.4°
C6C11H11106.2°109.5°
C6C7H7119.6°120.0°
C6C7C8120.7°120.0°
H7C7C8119.7°120.0°
C7C8H8120.0°120.0°
C7C8C9119.9°120.0°
H8C8C9120.0°120.0°
C8C9CL1118.9°120.0°
C13C11C17114.8°109.5°
C13C11H11106.2°109.5°
C11C13C14113.6°109.5°
C11C13H13108.4°109.5°
C11C13H13A108.4°109.5°
C17C11H11106.2°109.4°
C11C17C18123.0°119.6°
C11C17C26118.4°119.6°
C14C13H13108.4°109.4°
C14C13H13A108.4°109.5°
C13C14O15117.1°119.9°
C13C14O16118.4°120.0°
H13C13H13A109.5°109.4°
O15C14O16124.6°120.0°
C14O16HO16109.5°117.0°
C18C17C26118.6°120.8°
C17C18C19121.3°120.4°
C17C18H18119.4°119.8°
C17C26C25120.5°119.9°
C17C26H26119.7°120.1°
C19C18H18119.4°119.7°
C18C19H19120.1°120.1°
C18C19C20119.9°119.7°
H19C19C20120.1°120.2°
C19C20N21134.4°133.9°
C19C20C25120.0°119.9°
N21C20C25105.5°106.1°
C20N21C22129.6°126.8°
C20N21N23110.1°106.5°
C20C25N24107.3°107.7°
C20C25C26119.8°119.3°
C22N21N23120.4°126.8°
N21C22H22109.5°109.5°
N21C22H22B109.5°109.5°
N21C22H22A109.4°109.4°
N21N23N24107.2°109.4°
H22C22H22B109.5°109.5°
H22C22H22A109.5°109.5°
H22BC22H22A109.5°109.4°
N23N24C25109.9°110.3°
N24C25C26133.0°133.1°
C25C26H26119.8°120.0°
C30S27O28108.4°106.4°
C30S27O29108.3°106.4°
S27C30C35119.8°120.0°
S27C30C31119.9°120.0°
O28S27O29120.1°123.2°
C35C30C31120.3°120.0°
C30C35C34119.7°120.0°
C30C35H35120.1°120.0°
C30C31C32119.6°120.0°
C30C31H31120.2°120.0°
C32C31H31120.2°120.0°
C31C32C33120.1°120.0°
C31C32H32120.0°120.0°
C33C32H32120.0°120.0°
C32C33H33119.9°120.0°
C32C33C34120.2°120.0°
H33C33C34119.9°120.0°
C33C34H34119.9°120.0°
C33C34C35120.1°120.0°
H34C34C35119.9°120.0°
C34C35H35120.2°120.0°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
H1C1H1AH1B120.0°120.0°
H1C1H1AN2120.0°120.0°
H1C1H1BN2120.0°119.9°
H1C1N2C3180.0°30.0°
H1C1N2S2737.4°150.1°
H1AC1H1BN2120.0°120.0°
H1AC1N2C360.0°150.0°
H1AC1N2S2782.6°30.0°
H1BC1N2C360.0°89.9°
H1BC1N2S27157.4°90.0°
C1N2C3S27142.0°179.9°
C1N2C3H358.0°155.0°
C1N2C3C462.5°85.0°
C1N2C3H3A177.1°35.1°
C1N2S27C3063.8°90.0°
C1N2S27O2851.0°156.5°
C1N2S27O29178.8°23.5°
N2C3H3C4122.7°120.0°
N2C3H3H3A118.6°119.9°
N2C3C4H3A120.4°120.0°
N2C3C4C5100.3°105.2°
N2C3C4C979.7°75.0°
C3N2S27C3077.3°90.1°
C3N2S27O28167.9°23.5°
C3N2S27O2937.7°156.4°
S27N2C3H384.1°25.0°
S27N2C3C4155.5°94.9°
S27N2C3H3A35.1°145.0°
N2S27C30O28113.7°113.6°
N2S27C30O29114.5°113.5°
N2S27O28O29122.6°123.0°
N2S27C30C3585.5°90.3°
N2S27C30C3194.4°90.0°
H3C3C4H3A119.2°120.1°
H3C3C4C520.1°14.7°
H3C3C4C9159.9°165.0°
C3C4C5C9180.0°179.7°
C3C4C5C6180.0°180.0°
C3C4C5H50.0°0.0°
C3C4C9C8180.0°179.7°
C3C4C9CL10.0°0.0°
H3AC3C4C5139.2°134.8°
H3AC3C4C940.8°45.0°
C4C5C6H5180.0°180.0°
C4C5C6C11179.9°180.0°
C4C5C6C70.0°0.1°
C5C4C9C80.0°0.6°
C5C4C9CL1180.0°179.8°
C9C4C5C60.0°0.3°
C9C4C5H5180.0°179.7°
C4C9C8C70.0°0.6°
C4C9C8H8180.0°179.7°
C4C9C8CL1180.0°179.6°
C5C6C11C7180.0°180.0°
C5C6C7H7180.0°180.0°
C5C6C7C80.0°0.0°
C5C6C11C1385.8°128.1°
C5C6C11C1743.8°111.9°
C5C6C11H11158.7°8.1°
H5C5C6C110.1°0.0°
H5C5C6C7180.0°180.0°
C11C6C7H70.1°0.0°
C11C6C7C8179.9°180.0°
C6C11C13C17127.4°120.0°
C6C11C13H11115.5°120.0°
C6C11C17H11114.9°120.0°
C6C11C13C14170.5°65.0°
C6C11C13H1368.9°175.0°
C6C11C13H13A49.9°55.0°
C6C11C17C18114.5°68.3°
C6C11C17C2665.5°112.0°
C6C7H7C8180.0°180.0°
C6C7C8H8179.9°180.0°
C6C7C8C90.0°0.3°
C7C6C11C1394.3°51.8°
C7C6C11C17136.1°68.2°
C7C6C11H1121.2°171.9°
H7C7C8H80.1°0.0°
H7C7C8C9180.0°179.7°
C7C8H8C9180.0°179.7°
C7C8C9CL1180.0°179.7°
H8C8C9CL10.0°0.0°
C13C11C17H11117.0°120.0°
C11C13C14H13120.6°120.0°
C11C13C14H13A120.6°120.1°
C11C13H13H13A118.1°120.0°
C11C13C14O15135.9°0.0°
C11C13C14O1644.1°180.0°
C13C11C17C1813.6°51.7°
C13C11C17C26166.4°128.0°
C17C11C13C1462.0°175.0°
C17C11C13H1358.6°55.0°
C17C11C13H13A177.4°65.0°
C11C17C18C26180.0°179.7°
C11C17C18C19179.9°180.0°
C11C17C18H180.1°0.0°
C11C17C26C25179.9°179.8°
C11C17C26H260.1°0.1°
H11C11C13C1455.0°55.0°
H11C11C13H13175.6°65.0°
H11C11C13H13A65.6°175.0°
H11C11C17C18130.6°171.7°
H11C11C17C2649.4°8.0°
C14C13H13H13A118.1°120.0°
C13C14O15O16180.0°180.0°
C13C14O16HO16180.0°180.0°
H13C13C14O1515.3°120.0°
H13C13C14O16164.7°60.0°
H13AC13C14O15103.5°120.1°
H13AC13C14O1676.6°59.9°
O15C14O16HO160.0°0.0°
C17C18C19H18180.0°180.0°
C17C18C19H19179.9°180.0°
C17C18C19C200.1°0.0°
C18C17C26C250.1°0.5°
C18C17C26H26179.9°179.6°
C26C17C18C190.1°0.3°
C26C17C18H18179.9°179.8°
C17C26C25C200.1°0.5°
C17C26C25N24180.0°179.8°
C17C26C25H26180.0°179.8°
C18C19H19C20180.0°180.0°
C18C19C20N21180.0°180.0°
C18C19C20C250.1°0.0°
H18C18C19H190.2°0.0°
H18C18C19C20179.8°180.0°
H19C19C20N210.0°0.0°
H19C19C20C25179.8°180.0°
C19C20N21C25179.9°180.0°
C19C20N21C220.1°0.0°
C19C20N21N23179.9°180.0°
C19C20C25N24179.9°180.0°
C19C20C25C260.1°0.3°
C20N21C22N23179.9°180.0°
C20N21C22H22180.0°29.9°
C20N21C22H22B59.9°150.0°
C20N21C22H22A60.1°90.0°
C20N21N23N240.0°0.0°
N21C20C25N240.1°0.0°
N21C20C25C26180.0°179.8°
C25C20N21C22180.0°180.0°
C25C20N21N230.1°0.0°
C20C25N24N230.0°0.0°
C20C25N24C26179.9°179.8°
C20C25C26H26179.9°179.7°
N21C22H22H22B120.0°120.0°
N21C22H22H22A120.0°120.0°
N21C22H22BH22A120.0°120.0°
C22N21N23N24180.0°180.0°
N23N21C22H220.0°150.0°
N23N21C22H22B120.0°30.0°
N23N21C22H22A120.0°90.0°
N21N23N24C250.0°0.0°
H22C22H22BH22A120.0°120.0°
N23N24C25C26179.9°179.7°
N24C25C26H260.0°0.1°
C30S27O28O29125.2°122.9°
S27C30C35C31179.9°179.7°
S27C30C31C32180.0°179.9°
S27C30C31H310.0°0.1°
S27C30C35C34180.0°179.8°
S27C30C35H350.0°0.3°
O28S27C30C3528.2°156.2°
O28S27C30C31151.9°23.5°
O29S27C30C35160.0°23.2°
O29S27C30C3120.0°156.4°
C35C30C31C320.0°0.4°
C35C30C31H31180.0°179.7°
C30C35C34C330.1°0.5°
C30C35C34H34179.9°179.7°
C30C35C34H35180.0°179.5°
C30C31C32H31180.0°179.9°
C30C31C32C330.0°0.1°
C30C31C32H32180.0°179.9°
C31C30C35C340.1°0.6°
C31C30C35H35180.0°179.9°
C31C32C33H32180.0°180.0°
C31C32C33H33180.0°180.0°
C31C32C33C340.0°0.0°
H31C31C32C33180.0°180.0°
H31C31C32H320.0°0.1°
C32C33H33C34180.0°180.0°
C32C33C34H34179.9°179.9°
C32C33C34C350.1°0.2°
H32C32C33H330.0°0.1°
H32C32C33C34180.0°180.0°
H33C33C34H340.1°0.0°
H33C33C34C35179.9°179.8°
C33C34H34C35180.0°179.9°
C33C34C35H35179.9°180.0°
H34C34C35H350.1°0.2°

222415

PDB entries from 2024-07-10

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