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A1JD4

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C11O10sing1.43Å1.41Å
C11C12sing1.53Å1.50Å
O10C9sing1.42Å1.42Å
C12N13sing1.46Å1.48Å
C9C8sing1.52Å1.52Å
N13C8sing1.46Å1.48Å
N13C14sing1.37Å1.37Å
C8C7sing1.53Å1.52Å
O15C14doub1.22Å1.23Å
C14C16sing1.48Å1.47Å
C7N6sing1.47Å1.46Å
C16N6sing1.37Å1.39Å
C16C17doub1.38Å1.37Å
N6C5sing1.34Å1.37Å
O18C17sing1.36Å1.40Å
C17C19sing1.47Å1.49Å
C5C4doub1.36Å1.34Å
C31C27sing1.51Å1.50Å
C19C4sing1.41Å1.46Å
C19O20doub1.22Å1.23Å
C4O3sing1.36Å1.37Å
N28C27doub1.31Å1.33ÅAromatic
N28C29sing1.34Å1.37ÅAromatic
C27C26sing1.39Å1.40ÅAromatic
C30C29doub1.41Å1.42ÅAromatic
C30C21sing1.36Å1.37ÅAromatic
C29C24sing1.42Å1.41ÅAromatic
C26C25doub1.37Å1.36ÅAromatic
O3C2sing1.43Å1.47Å
C2C21sing1.51Å1.51Å
C2C1sing1.53Å1.52Å
C21C22doub1.39Å1.39ÅAromatic
C24C25sing1.41Å1.41ÅAromatic
C24C23doub1.40Å1.41ÅAromatic
C22C23sing1.36Å1.36ÅAromatic
C5H5sing1.08Å1.08Å
C7H7Asing1.09Å1.10Å
C7H7Bsing1.09Å1.10Å
C8H8sing1.09Å1.10Å
C22H22sing1.08Å1.08Å
C26H26sing1.08Å1.08Å
C1H1Asing1.09Å1.10Å
C1H1Csing1.09Å1.10Å
C1H1Bsing1.09Å1.10Å
C2H2sing1.09Å1.10Å
C9H9Bsing1.09Å1.10Å
C9H9Asing1.09Å1.10Å
C11H11Bsing1.09Å1.10Å
C11H11Asing1.09Å1.10Å
C12H12Bsing1.09Å1.10Å
C12H12Asing1.09Å1.10Å
O18H18sing0.97Å0.95Å
C23H23sing1.08Å1.08Å
C25H25sing1.08Å1.08Å
C30H30sing1.08Å1.08Å
C31H31Bsing1.09Å1.10Å
C31H31Csing1.09Å1.10Å
C31H31Asing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
O10C11C12110.7°108.2°
C11O10C9109.9°113.1°
O10C11H11B109.2°109.7°
O10C11H11A109.2°109.6°
C11C12N13110.5°110.1°
C12C11H11B109.1°109.8°
C12C11H11A109.2°109.7°
C11C12H12B109.2°109.3°
C11C12H12A109.2°109.3°
O10C9C8111.7°111.8°
O10C9H9B108.9°109.0°
O10C9H9A108.9°108.9°
C12N13C8118.1°123.3°
C12N13C14118.4°117.8°
N13C12H12B109.2°109.7°
N13C12H12A109.2°109.3°
C9C8N13110.6°112.7°
C9C8C7107.0°108.8°
C9C8H8109.9°108.4°
C8C9H9B108.9°109.0°
C8C9H9A108.9°109.0°
C8N13C14122.0°118.9°
N13C8C7108.8°110.1°
N13C8H8110.4°108.4°
N13C14O15119.5°120.6°
N13C14C16116.3°118.9°
C8C7N6109.2°109.0°
C8C7H7A109.5°109.5°
C8C7H7B109.5°109.6°
C7C8H8109.9°108.3°
O15C14C16124.0°120.5°
C14C16N6120.9°118.7°
C14C16C17120.7°120.9°
C7N6C16118.5°117.8°
C7N6C5118.4°120.5°
N6C7H7A109.6°109.5°
N6C7H7B109.5°109.6°
N6C16C17118.2°120.5°
C16N6C5123.0°121.7°
C16C17O18124.9°120.9°
C16C17C19120.2°118.2°
N6C5C4122.8°121.8°
N6C5H5118.6°119.1°
O18C17C19114.9°120.9°
C17O18H18109.5°114.0°
C17C19C4117.7°118.0°
C17C19O20119.8°121.0°
C5C4C19118.1°119.7°
C5C4O3129.4°120.1°
C4C5H5118.6°119.1°
C31C27N28116.8°119.1°
C31C27C26121.0°119.1°
C27C31H31B109.5°109.5°
C27C31H31C109.5°109.5°
C27C31H31A109.5°109.5°
C4C19O20122.5°121.0°
C19C4O3112.3°120.1°
C4O3C2117.7°117.0°
C27N28C29119.1°121.3°
N28C27C26122.1°121.8°
N28C29C30118.6°121.1°
N28C29C24121.7°119.8°
C27C26C25119.7°119.9°
C27C26H26120.1°120.0°
C29C30C21120.4°119.8°
C30C29C24119.6°119.1°
C29C30H30119.8°120.1°
C30C21C2119.9°119.5°
C30C21C22119.5°121.0°
C21C30H30119.8°120.1°
C29C24C25117.2°119.0°
C29C24C23118.2°119.6°
C26C25C24120.1°118.2°
C25C26H26120.1°120.0°
C26C25H25120.0°120.9°
O3C2C21109.5°109.5°
O3C2C1106.3°109.5°
O3C2H2109.6°109.5°
C21C2C1113.4°109.5°
C2C21C22120.6°119.5°
C21C2H2109.0°109.5°
C2C1H1A109.5°109.4°
C2C1H1C109.5°109.4°
C2C1H1B109.5°109.5°
C1C2H2109.0°109.5°
C21C22C23121.4°120.9°
C21C22H22119.3°119.5°
C25C24C23124.6°121.4°
C24C25H25120.0°121.0°
C24C23C22120.9°119.6°
C24C23H23119.5°120.2°
C23C22H22119.3°119.6°
C22C23H23119.5°120.2°
H7AC7H7B109.5°109.6°
H1AC1H1C109.5°109.5°
H1AC1H1B109.5°109.5°
H1CC1H1B109.5°109.5°
H9BC9H9A109.5°109.0°
H11BC11H11A109.5°109.8°
H12BC12H12A109.4°109.1°
H31BC31H31C109.5°109.4°
H31BC31H31A109.5°109.5°
H31CC31H31A109.4°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
O10C11C12H11B120.2°119.6°
O10C11C12H11A120.2°119.6°
O10C11C12N1353.3°50.6°
C11O10C9C863.8°59.8°
C11O10C9H9B56.6°179.6°
C11O10C9H9A175.9°60.7°
O10C11H11BH11A119.5°120.5°
O10C11C12H12B66.9°69.9°
O10C11C12H12A173.5°170.7°
C12C11O10C966.6°67.5°
C11C12N13H12B120.2°120.3°
C11C12N13H12A120.2°120.1°
C11C12N13C840.6°33.6°
C11C12N13C14153.2°148.5°
C12C11H11BH11A119.4°120.7°
C11C12H12BH12A119.5°119.5°
O10C9C8H9B120.4°120.6°
O10C9C8H9A120.3°120.5°
O10C9C8N1347.7°35.8°
O10C9C8C7166.1°158.1°
O10C9C8H874.5°84.2°
O10C9H9BH9A119.0°118.8°
C9O10C11H11B173.3°172.8°
C9O10C11H11A53.6°52.2°
C12N13C8C937.8°26.0°
C12N13C8C14165.6°177.9°
C12N13C8C7155.1°147.6°
C12N13C14O153.7°7.1°
C12N13C14C16171.8°172.4°
C12N13C8H884.2°94.1°
N13C12C11H11B173.5°170.3°
N13C12C11H11A66.9°69.0°
N13C12H12BH12A119.5°119.7°
C9C8N13C7117.3°121.6°
C9C8N13H8121.9°120.0°
C9C8N13C14156.6°156.1°
C9C8C7H8119.4°117.7°
C9C8C7N6174.9°178.9°
C9C8C7H7A54.9°61.3°
C9C8C7H7B65.2°59.0°
C8C9H9BH9A119.0°118.9°
N13C8C7H8121.0°118.4°
C8N13C14O15169.3°174.9°
C8N13C14C166.2°5.7°
N13C8C7N655.3°57.2°
N13C8C7H7A64.7°62.7°
N13C8C7H7B175.2°177.1°
N13C8C9H9B72.6°156.4°
N13C8C9H9A168.0°84.7°
C8N13C12H12B79.6°86.7°
C8N13C12H12A160.8°153.7°
C14N13C8C739.3°34.5°
N13C14O15C16175.2°179.5°
N13C14C16N610.3°24.2°
N13C14C16C17164.7°155.8°
C14N13C8H881.5°83.9°
C14N13C12H12B86.6°91.2°
C14N13C12H12A33.1°28.4°
C8C7N6H7A120.0°119.8°
C8C7N6H7B119.9°120.0°
C8C7N6C1643.4°41.6°
C8C7N6C5138.3°138.5°
C8C7H7AH7B120.1°120.3°
C7C8C9H9B45.7°81.2°
C7C8C9H9A73.6°37.6°
O15C14C16N6174.3°156.3°
O15C14C16C1710.6°23.7°
C14C16N6C710.1°2.1°
C14C16N6C17175.2°180.0°
C14C16N6C5171.7°178.0°
C14C16C17O183.4°0.5°
C14C16C17C19173.5°179.0°
C7N6C16C5178.2°179.9°
C7N6C16C17174.7°177.9°
C7N6C5C4173.6°178.1°
C7N6C5H56.4°1.8°
N6C7H7AH7B120.1°120.2°
N6C7C8H865.8°61.2°
N6C16C17O18178.6°179.5°
N6C16C17C191.7°1.0°
C16N6C5C44.5°1.7°
C16N6C5H5175.4°178.3°
C16N6C7H7A76.6°78.2°
C16N6C7H7B163.3°161.6°
C17C16N6C53.5°2.0°
C16C17O18C19177.1°179.5°
C16C17C19C40.8°0.2°
C16C17C19O20178.2°179.3°
C16C17O18H181.0°179.5°
N6C5C4H5180.0°180.0°
N6C5C4C193.5°0.5°
N6C5C4O3170.9°179.8°
C5N6C7H7A101.7°101.7°
C5N6C7H7B18.4°18.5°
O18C17C19C4178.1°179.3°
O18C17C19O201.0°1.2°
C17C19C4C51.7°0.4°
C17C19C4O20179.0°179.4°
C17C19C4O3173.6°179.3°
C19C17O18H18178.1°0.0°
C5C4C19O3175.3°179.7°
C5C4C19O20177.3°179.0°
C5C4O3C28.6°5.4°
C31C27N28C26179.3°178.8°
C31C27N28C29179.5°179.5°
C31C27C26C25179.4°180.0°
C31C27C26H260.6°0.0°
C27C31H31BH31C120.0°120.0°
C27C31H31BH31A120.0°120.0°
C27C31H31CH31A120.0°120.0°
C19C4O3C2166.1°174.9°
C19C4C5H5176.5°179.5°
O20C19C4O37.4°1.3°
C4O3C2C2171.7°155.4°
C4O3C2C1165.4°84.5°
O3C4C5H59.1°0.2°
C4O3C2H247.7°35.4°
C27N28C29C30179.3°178.6°
C27N28C29C240.0°1.1°
N28C27C26C250.2°1.2°
N28C27C26H26179.9°178.9°
N28C27C31H31B0.0°91.1°
N28C27C31H31C120.0°28.9°
N28C27C31H31A120.0°148.9°
C29N28C27C260.2°1.7°
N28C29C30C24179.3°179.7°
N28C29C30C21178.9°179.8°
N28C29C24C250.3°0.0°
N28C29C24C23179.1°179.5°
N28C29C30H301.1°0.4°
C27C26C25H26180.0°180.0°
C27C26C25C240.1°0.1°
C27C26C25H25179.9°180.0°
C26C27C31H31B179.3°90.0°
C26C27C31H31C59.3°150.0°
C26C27C31H31A60.7°29.9°
C29C30C21H30180.0°179.4°
C29C30C21C2177.9°179.7°
C29C30C21C220.5°0.1°
C30C29C24C25179.5°179.7°
C30C29C24C230.1°0.8°
C21C30C29C240.4°0.5°
C30C21C2O3129.0°145.3°
C30C21C2C22178.4°179.8°
C30C21C2C1112.4°94.7°
C30C21C22C230.3°0.2°
C30C21C22H22179.7°179.7°
C30C21C2H29.2°25.3°
C29C24C25C260.3°0.5°
C29C24C25C23179.4°179.5°
C29C24C23C220.1°0.5°
C29C24C23H23179.9°179.4°
C29C24C25H25179.7°179.4°
C24C29C30H30179.6°179.9°
C26C25C24H25180.0°179.9°
C26C25C24C23179.0°180.0°
O3C2C21C1118.6°120.0°
O3C2C21H2119.8°120.0°
O3C2C1H2118.0°120.0°
O3C2C21C2249.4°35.0°
O3C2C1H1A180.0°59.9°
O3C2C1H1C60.0°60.0°
O3C2C1H1B60.0°180.0°
C21C2C1H2121.6°120.0°
C2C21C22C23178.1°180.0°
C2C21C22H221.9°0.0°
C21C2C1H1A59.7°180.0°
C21C2C1H1C179.6°60.0°
C21C2C1H1B60.3°60.0°
C2C21C30H302.1°0.3°
C1C2C21C2269.2°85.0°
C2C1H1AH1C120.0°119.9°
C2C1H1AH1B120.0°120.0°
C2C1H1CH1B120.0°120.0°
C21C22C23C240.0°0.0°
C21C22C23H22180.0°179.9°
C22C21C2H2169.2°155.0°
C21C22C23H23180.0°179.9°
C22C21C30H30179.5°179.5°
C25C24C23C22179.3°180.0°
C24C25C26H26179.9°179.9°
C25C24C23H230.7°0.1°
C24C23C22H23180.0°179.9°
C24C23C22H22180.0°180.0°
C23C24C25H251.0°0.1°
H7AC7C8H8174.2°179.0°
H7BC7C8H854.2°58.7°
H8C8C9H9B165.1°36.4°
H8C8C9H9A45.8°155.3°
H22C22C23H230.0°0.0°
H26C26C25H250.1°0.1°
H1AC1H1CH1B120.0°120.1°
H1AC1C2H262.0°60.0°
H1CC1C2H258.0°180.0°
H1BC1C2H2178.0°60.0°
H11BC11C12H12B53.3°49.7°
H11BC11C12H12A66.3°69.7°
H11AC11C12H12B172.9°170.5°
H11AC11C12H12A53.3°51.1°
H31BC31H31CH31A120.0°120.0°

255900

PDB entries from 2026-07-01

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