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0K1

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C29C27sing1.53Å1.54Å
C29C31sing1.53Å1.54Å
C22N20sing1.46Å1.47Å
C27C28sing1.53Å1.54Å
C27C23sing1.53Å1.56Å
C31C32sing1.53Å1.55Å
C31C26sing1.53Å1.53Å
C28C30sing1.53Å1.54Å
C32C30sing1.53Å1.54Å
N20N21sing1.40Å1.26ÅAromatic
N20C18sing1.35Å1.34ÅAromatic
N21C19doub1.31Å1.35ÅAromatic
C18C17doub1.36Å1.37ÅAromatic
C30O33sing1.43Å1.42Å
C30C25sing1.53Å1.54Å
C23N16sing1.46Å1.49Å
C23C24sing1.53Å1.54Å
C26C24sing1.53Å1.54Å
C19C17sing1.41Å1.37ÅAromatic
C17C4sing1.48Å1.48Å
N16C14sing1.35Å1.38Å
C24C25sing1.53Å1.54Å
C4C2doub1.39Å1.40ÅAromatic
C4C6sing1.39Å1.39ÅAromatic
C2C1sing1.39Å1.39ÅAromatic
C14O15doub1.22Å1.20Å
C14C8sing1.48Å1.49Å
C6C5doub1.38Å1.38ÅAromatic
N10C8doub1.33Å1.39ÅAromatic
N10C12sing1.33Å1.39ÅAromatic
C1C12sing1.48Å1.51Å
C1C3doub1.39Å1.40ÅAromatic
C8C7sing1.41Å1.39ÅAromatic
C5C3sing1.38Å1.39ÅAromatic
C12C11doub1.40Å1.39ÅAromatic
C7N13sing1.38Å1.40Å
C7N9doub1.33Å1.38ÅAromatic
C11N9sing1.32Å1.39ÅAromatic
C2H1sing1.08Å1.08Å
C3H2sing1.08Å1.08Å
C5H3sing1.08Å1.08Å
C6H4sing1.08Å1.08Å
C11H5sing1.08Å1.08Å
N13H6sing0.97Å1.00Å
N13H7sing0.97Å1.00Å
C18H8sing1.08Å1.08Å
C19H9sing1.08Å1.08Å
C23H10sing1.09Å1.10Å
C24H11sing1.09Å1.10Å
C27H12sing1.09Å1.10Å
C31H13sing1.09Å1.10Å
C32H14sing1.09Å1.10Å
C32H15sing1.09Å1.10Å
N16H16sing0.97Å1.00Å
C29H17sing1.09Å1.10Å
C29H18sing1.09Å1.10Å
O33H19sing0.97Å0.95Å
C28H20sing1.09Å1.10Å
C28H21sing1.09Å1.10Å
C25H22sing1.09Å1.10Å
C25H23sing1.09Å1.10Å
C26H24sing1.09Å1.10Å
C26H25sing1.09Å1.10Å
C22H26sing1.09Å1.10Å
C22H27sing1.09Å1.10Å
C22H28sing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C27C29C31109.7°109.5°
C29C27C28107.7°109.5°
C29C27C23109.0°109.5°
C29C27H12109.6°109.4°
C27C29H17109.4°109.5°
C27C29H18109.4°109.5°
C29C31C32111.1°109.5°
C29C31C26108.6°109.4°
C29C31H13109.6°109.4°
C31C29H17109.4°109.5°
C31C29H18109.4°109.5°
C22N20N21124.5°125.9°
C22N20C18124.5°125.9°
N20C22H26109.5°109.5°
N20C22H27109.5°109.5°
N20C22H28109.5°109.4°
C28C27C23111.5°109.5°
C27C28C30110.2°109.5°
C28C27H12109.7°109.5°
C27C28H20109.3°109.5°
C27C28H21109.3°109.4°
C27C23N16112.3°109.4°
C27C23C24108.5°109.4°
C27C23H10108.8°109.5°
C23C27H12109.4°109.5°
C32C31C26108.2°109.5°
C31C32C30109.4°109.5°
C32C31H13109.5°109.5°
C31C32H14109.5°109.5°
C31C32H15109.5°109.5°
C31C26C24110.5°109.5°
C26C31H13109.8°109.5°
C31C26H24109.2°109.5°
C31C26H25109.2°109.5°
C28C30C32107.2°109.5°
C28C30O33109.6°109.5°
C28C30C25111.7°109.5°
C30C28H20109.3°109.5°
C30C28H21109.3°109.5°
C32C30O33111.2°109.5°
C32C30C25108.6°109.5°
C30C32H14109.5°109.5°
C30C32H15109.5°109.4°
N21N20C18111.0°108.2°
N20N21C19108.5°108.6°
N20C18C17107.6°107.6°
N20C18H8126.2°126.2°
N21C19C17108.6°108.1°
N21C19H9125.7°126.0°
C18C17C19104.3°107.5°
C18C17C4127.9°126.2°
C17C18H8126.2°126.2°
O33C30C25108.5°109.4°
C30O33H19109.5°114.0°
C30C25C24109.9°109.4°
C30C25H22109.4°109.5°
C30C25H23109.4°109.5°
N16C23C24108.4°109.5°
C23N16C14132.6°120.0°
N16C23H10109.8°109.5°
C23N16H16113.7°120.0°
C23C24C26110.4°109.5°
C23C24C25110.0°109.5°
C24C23H10109.0°109.5°
C23C24H11109.4°109.5°
C26C24C25108.2°109.5°
C26C24H11109.5°109.5°
C24C26H24109.2°109.4°
C24C26H25109.2°109.5°
C19C17C4127.8°126.3°
C17C19H9125.7°125.9°
C17C4C2120.4°120.0°
C17C4C6120.0°120.1°
N16C14O15120.8°120.0°
N16C14C8117.2°120.0°
C14N16H16113.7°120.0°
C25C24H11109.5°109.5°
C24C25H22109.4°109.5°
C24C25H23109.4°109.4°
C2C4C6119.6°119.9°
C4C2C1121.3°119.7°
C4C2H1119.4°120.2°
C4C6C5119.7°120.1°
C4C6H4120.1°120.0°
C2C1C12119.4°120.1°
C2C1C3118.0°119.9°
C1C2H1119.4°120.1°
O15C14C8122.0°120.0°
C14C8N10118.8°120.1°
C14C8C7122.0°120.1°
C6C5C3120.5°120.3°
C6C5H3119.7°119.9°
C5C6H4120.2°119.9°
C8N10C12122.5°120.0°
N10C8C7119.1°119.8°
N10C12C1119.4°120.0°
N10C12C11117.3°120.1°
C12C1C3122.6°120.0°
C1C12C11123.2°119.9°
C1C3C5121.0°120.1°
C1C3H2119.5°120.0°
C8C7N13120.9°120.1°
C8C7N9119.5°119.9°
C5C3H2119.5°119.9°
C3C5H3119.8°119.9°
C12C11N9120.8°120.2°
C12C11H5119.6°119.9°
N13C7N9119.6°120.0°
C7N13H6109.5°120.0°
C7N13H7109.5°120.0°
C7N9C11120.8°120.1°
N9C11H5119.6°120.0°
H6N13H7109.5°120.1°
H14C32H15109.5°109.5°
H17C29H18109.5°109.5°
H20C28H21109.5°109.5°
H22C25H23109.4°109.5°
H24C26H25109.5°109.4°
H26C22H27109.5°109.5°
H26C22H28109.4°109.5°
H27C22H28109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C27C29C31H17120.1°120.0°
C27C29C31H18120.0°120.0°
C29C27C28C23119.5°120.0°
C29C27C28H12119.2°120.0°
C29C27C23H12119.8°119.9°
C27C29C31C3257.8°60.0°
C27C29C31C2661.1°60.0°
C29C27C28C3063.7°60.0°
C29C27C23N16179.6°180.0°
C29C27C23C2459.9°60.0°
C29C27C23H1058.6°60.0°
C27C29C31H13179.0°180.0°
C27C29H17H18119.9°120.0°
C29C27C28H2056.4°59.9°
C29C27C28H21176.2°180.0°
C31C29C27C2859.2°60.0°
C31C29C27C2361.8°60.0°
C29C31C32C26119.1°120.0°
C29C31C32H13121.2°120.0°
C29C31C26H13119.8°120.0°
C29C31C32C3058.4°60.0°
C29C31C26C2459.5°60.0°
C31C29C27H12178.5°180.0°
C29C31C32H14178.3°60.0°
C29C31C32H1561.6°180.0°
C31C29H17H18119.9°120.0°
C29C31C26H2460.6°180.0°
C29C31C26H25179.7°60.0°
C22N20N21C18179.7°179.9°
C22N20N21C19179.7°179.9°
C22N20C18C17179.7°179.8°
C22N20C18H80.2°0.3°
N20C22H26H27120.0°120.0°
N20C22H26H28120.0°119.9°
N20C22H27H28120.0°119.9°
C28C27C23H12121.5°120.0°
C27C28C30H20120.1°120.0°
C27C28C30H21120.1°120.0°
C27C28C30C3264.1°60.0°
C27C28C30O33175.0°180.0°
C27C28C30C2554.8°60.0°
C28C27C23N1660.9°60.0°
C28C27C23C2458.9°60.0°
C28C27C23H10177.4°180.0°
C28C27C29H17179.3°180.0°
C28C27C29H1860.8°60.0°
C27C28H20H21119.7°120.0°
C23C27C28C3055.8°60.0°
C27C23N16C24119.8°120.0°
C27C23N16H10121.2°120.0°
C27C23C24H10118.3°120.0°
C27C23C24C2658.7°60.0°
C27C23N16C14147.4°85.1°
C27C23C24C2560.6°60.0°
C27C23C24H11179.2°180.0°
C27C23N16H1632.6°95.0°
C23C27C29H1758.3°59.9°
C23C27C29H18178.2°180.0°
C23C27C28H20175.9°180.0°
C23C27C28H2164.3°60.0°
C32C31C26H13119.5°120.1°
C31C32C30C2860.0°60.0°
C31C32C30H14120.0°120.0°
C31C32C30H15120.0°120.0°
C31C32C30O33179.9°180.0°
C31C32C30C2560.8°60.0°
C32C31C26C2461.1°60.0°
C31C32H14H15120.1°120.0°
C32C31C29H17177.8°180.0°
C32C31C29H1862.2°60.0°
C32C31C26H24178.7°60.0°
C32C31C26H2559.1°180.0°
C26C31C32C3060.7°60.0°
C31C26C24C2359.4°60.0°
C31C26C24H24120.2°120.0°
C31C26C24H25120.2°120.1°
C31C26C24C2560.9°60.0°
C31C26C24H11179.9°180.0°
C26C31C32H1459.3°180.0°
C26C31C32H15179.3°60.0°
C26C31C29H1759.0°60.0°
C26C31C29H18178.9°180.0°
C31C26H24H25119.5°120.0°
C28C30C32O33119.9°120.0°
C28C30C32C25120.8°120.0°
C28C30O33C25122.2°120.0°
C28C30C25C2457.1°60.0°
C30C28C27H12177.1°180.0°
C28C30C32H14180.0°60.0°
C28C30C32H1560.0°180.0°
C28C30O33H19180.0°60.0°
C30C28H20H21119.7°120.0°
C28C30C25H22177.2°60.0°
C28C30C25H2363.0°179.9°
C32C30O33C25119.4°120.0°
C32C30C25C2460.9°60.0°
C30C32C31H13179.6°180.0°
C30C32H14H15120.0°119.9°
C32C30O33H1961.6°60.0°
C32C30C28H2056.0°60.0°
C32C30C28H21175.8°180.0°
C32C30C25H2259.1°179.9°
C32C30C25H23179.0°60.0°
N21N20C18C170.0°0.1°
N20N21C19C170.9°0.1°
N21N20C18H8180.0°179.8°
N20N21C19H9179.1°179.8°
N21N20C22H260.0°90.0°
N21N20C22H27120.0°150.0°
N21N20C22H28120.0°30.0°
C18N20N21C190.6°0.0°
N20C18C17H8180.0°180.0°
N20C18C17C190.5°0.2°
N20C18C17C4179.0°180.0°
C18N20C22H26179.7°89.9°
C18N20C22H2760.3°30.1°
C18N20C22H2859.7°150.1°
N21C19C17C180.9°0.2°
N21C19C17H9180.0°180.0°
N21C19C17C4179.3°180.0°
C18C17C19C4178.5°179.8°
C18C17C4C214.8°180.0°
C18C17C4C6166.6°0.0°
C18C17C19H9179.1°179.7°
O33C30C25C24178.0°180.0°
O33C30C32H1460.1°60.0°
O33C30C32H1559.9°60.0°
O33C30C28H2064.9°60.0°
O33C30C28H2154.9°60.0°
O33C30C25H2261.9°60.0°
O33C30C25H2357.9°60.1°
C30C25C24C2360.3°60.0°
C30C25C24C2660.3°60.0°
C30C25C24H22120.1°120.0°
C30C25C24H23120.1°120.0°
C30C25C24H11179.5°180.0°
C25C30C32H1459.2°180.0°
C25C30C32H15179.2°60.0°
C25C30O33H1957.8°180.0°
C25C30C28H20174.9°180.0°
C25C30C28H2165.3°59.9°
C30C25H22H23119.8°120.1°
N16C23C24H10119.5°120.0°
N16C23C24C26179.1°180.0°
C23N16C14H16180.0°179.9°
N16C23C24C2561.6°60.0°
C23N16C14O150.9°0.0°
C23N16C14C8179.0°180.0°
N16C23C24H1158.6°60.0°
N16C23C27H1260.6°60.1°
C23C24C26C25120.3°120.0°
C23C24C26H11120.5°120.0°
C24C23N16C1492.8°155.0°
C23C24C25H11120.2°120.0°
C24C23C27H12179.7°180.0°
C24C23N16H1687.2°24.9°
C23C24C25H22179.6°60.0°
C23C24C25H2359.8°180.0°
C23C24C26H2460.7°180.0°
C23C24C26H25179.6°60.0°
C26C24C25H11119.2°120.0°
C26C24C23H1059.7°60.0°
C24C26C31H13179.4°180.0°
C26C24C25H2259.8°180.0°
C26C24C25H23179.6°60.0°
C24C26H24H25119.5°120.0°
C19C17C4C2163.3°0.3°
C19C17C4C615.3°179.7°
C19C17C18H8179.5°179.7°
C17C4C2C6178.7°180.0°
C17C4C2C1179.6°180.0°
C17C4C6C5179.2°179.8°
C17C4C2H10.4°0.0°
C17C4C6H40.8°0.0°
C4C17C18H81.0°0.0°
C4C17C19H90.6°0.0°
N16C14O15C8178.0°180.0°
N16C14C8N100.7°5.6°
N16C14C8C7178.3°174.4°
C14N16C23H1026.2°34.9°
C25C24C23H10178.9°180.0°
C24C25H22H23119.8°120.0°
C25C24C26H24179.0°60.0°
C25C24C26H2559.3°180.0°
C4C2C1H1180.0°180.0°
C2C4C6C50.5°0.2°
C4C2C1C12179.4°180.0°
C4C2C1C31.2°0.3°
C2C4C6H4179.5°180.0°
C6C4C2C11.0°0.0°
C4C6C5H4180.0°179.7°
C4C6C5C30.3°0.2°
C6C4C2H1179.0°180.0°
C4C6C5H3179.7°179.7°
C2C1C12N109.4°179.7°
C2C1C12C3178.2°179.7°
C2C1C3C51.0°0.3°
C2C1C12C11168.8°0.2°
C2C1C3H2179.0°179.7°
O15C14C8N10177.4°174.4°
O15C14C8C70.3°5.6°
O15C14N16H16179.1°179.9°
C14C8N10C7177.7°180.0°
C14C8N10C12179.3°180.0°
C14C8C7N131.8°0.0°
C14C8C7N9178.6°179.7°
C8C14N16H161.0°0.0°
C6C5C3C10.6°0.1°
C6C5C3H3180.0°179.9°
C6C5C3H2179.4°180.0°
C8N10C12C1179.5°180.0°
C8N10C12C111.1°0.1°
N10C8C7N13179.4°180.0°
N10C8C7N90.9°0.3°
N10C12C1C11178.3°179.9°
N10C12C1C3172.4°0.0°
C12N10C8C71.6°0.0°
N10C12C11N90.1°0.2°
N10C12C11H5179.9°179.7°
C12C1C3C5179.2°180.0°
C1C12C11N9178.4°179.7°
C12C1C2H10.5°0.0°
C12C1C3H20.8°0.1°
C1C12C11H51.6°0.3°
C1C3C5H2180.0°179.9°
C3C1C12C119.3°179.9°
C3C1C2H1178.8°179.7°
C1C3C5H3179.4°180.0°
C8C7N13N9179.7°179.7°
C8C7N9C110.1°0.6°
C8C7N13H6179.7°174.2°
C8C7N13H759.7°5.8°
C3C5C6H4179.7°180.0°
C12C11N9C70.5°0.5°
C12C11N9H5180.0°179.5°
N13C7N9C11179.6°179.7°
C7N13H6H7120.0°180.0°
C7N9C11H5179.5°180.0°
N9C7N13H60.0°5.4°
N9C7N13H7120.0°174.5°
H2C3C5H30.6°0.1°
H3C5C6H40.3°0.0°
H10C23C24H1160.8°60.0°
H10C23C27H1261.2°60.0°
H10C23N16H16153.8°145.0°
H11C24C25H2259.4°60.0°
H11C24C25H2360.4°60.1°
H11C24C26H2459.8°60.0°
H11C24C26H2559.9°59.9°
H12C27C29H1761.4°60.0°
H12C27C29H1858.5°60.0°
H12C27C28H2062.8°60.0°
H12C27C28H2157.0°60.0°
H13C31C32H1460.4°60.0°
H13C31C32H1559.6°60.1°
H13C31C29H1761.0°60.0°
H13C31C29H1859.0°60.0°
H13C31C26H2459.2°60.1°
H13C31C26H2560.4°59.9°
H26C22H27H28120.0°120.1°

226262

PDB entries from 2024-10-16

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