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A1BCY

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C1O2sing1.43Å1.43Å
O2C3sing1.36Å1.36Å
C3C11doub1.41Å1.40ÅAromatic
C11C10sing1.41Å1.43ÅAromatic
C10C9doub1.36Å1.38ÅAromatic
C9C12sing1.47Å1.46Å
C12N14sing1.35Å1.34Å
N14C15sing1.47Å1.46Å
C15C21sing1.51Å1.53Å
C21N23sing1.35Å1.34Å
N23C24sing1.47Å1.46Å
C24C26sing1.51Å1.50Å
C26N38doub1.28Å1.31Å
C24C34sing1.53Å1.53Å
C34C36sing1.53Å1.52Å
S37C36sing1.81Å1.78Å
S37O39doub1.42Å1.44Å
S37C40sing1.81Å1.76Å
S37O41doub1.42Å1.44Å
C21O22doub1.21Å1.23Å
C15C17sing1.53Å1.53Å
C17C42sing1.53Å1.52Å
C42C43sing1.53Å1.48Å
C43C44sing1.53Å1.49Å
C12O13doub1.22Å1.24Å
C9N8sing1.38Å1.38ÅAromatic
N8C7sing1.38Å1.39ÅAromatic
C7C6doub1.39Å1.39ÅAromatic
C6C5sing1.38Å1.39ÅAromatic
C5C4doub1.39Å1.39ÅAromatic
C4C3sing1.38Å1.39ÅAromatic
C7C11sing1.41Å1.41ÅAromatic
C44C42sing1.53Å1.48Å
C4H4sing1.08Å1.08Å
C5H5sing1.08Å1.08Å
C6H6sing1.08Å1.08Å
C10H8sing1.08Å1.08Å
C15H10sing1.09Å1.10Å
C17H17sing1.09Å1.10Å
C17H170sing1.09Å1.10Å
C24H21sing1.09Å1.10Å
C26H23sing1.08Å1.08Å
C1H3sing1.09Å1.10Å
C1H1sing1.09Å1.10Å
C1H2sing1.09Å1.10Å
C34H34sing1.09Å1.10Å
C34H340sing1.09Å1.10Å
C36H33sing1.09Å1.10Å
C36H32sing1.09Å1.10Å
C40H40Bsing1.09Å1.10Å
C40H40Asing1.09Å1.10Å
C40H40Csing1.09Å1.10Å
C42H42sing1.09Å1.10Å
C43H43Bsing1.09Å1.10Å
C43H43Asing1.09Å1.10Å
C44H44Bsing1.09Å1.10Å
C44H44Asing1.09Å1.10Å
N14H9sing0.97Å1.00Å
N23H20sing0.97Å1.00Å
N38H38sing0.97Å1.00Å
N8H7sing0.97Å1.00Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C1O2C3117.4°117.0°
O2C1H3109.5°109.5°
O2C1H1109.5°109.5°
O2C1H2109.5°109.5°
O2C3C11115.3°120.2°
O2C3C4124.7°120.2°
C3C11C10134.5°133.4°
C11C3C4120.0°119.6°
C3C11C7118.4°119.6°
C11C10C9107.4°107.8°
C10C11C7107.0°107.0°
C11C10H8126.3°126.1°
C10C9C12130.9°125.5°
C10C9N8109.3°109.1°
C9C10H8126.3°126.1°
C9C12N14116.0°120.0°
C9C12O13121.4°120.0°
C12C9N8119.7°125.4°
C12N14C15118.1°120.0°
N14C12O13122.5°120.0°
C12N14H9121.0°120.0°
N14C15C21111.9°109.5°
N14C15C17110.0°109.4°
N14C15H10107.1°109.5°
C15N14H9121.0°120.0°
C15C21N23116.1°120.0°
C15C21O22120.5°120.1°
C21C15C17114.9°109.5°
C21C15H10106.3°109.5°
C21N23C24121.8°120.1°
N23C21O22123.3°119.9°
C21N23H20119.1°120.0°
N23C24C26110.5°109.4°
N23C24C34108.1°109.5°
N23C24H21108.6°109.4°
C24N23H20119.1°120.0°
C24C26N38131.0°120.1°
C26C24C34113.6°109.5°
C26C24H21108.1°109.5°
C24C26H23114.5°119.9°
N38C26H23114.5°120.0°
C26N38H38112.0°120.0°
C24C34C36112.1°109.5°
C34C24H21107.8°109.5°
C24C34H34108.8°109.5°
C24C34H340108.8°109.5°
C34C36S37112.3°109.5°
C36C34H34108.8°109.4°
C36C34H340108.8°109.5°
C34C36H33108.7°109.5°
C34C36H32108.8°109.5°
C36S37O39108.2°108.6°
C36S37C40104.7°101.9°
C36S37O41108.2°108.6°
S37C36H33108.8°109.5°
S37C36H32108.7°109.5°
O39S37C40108.7°108.6°
O39S37O41117.5°119.3°
C40S37O41108.8°108.5°
S37C40H40B109.5°109.4°
S37C40H40A109.4°109.5°
S37C40H40C109.5°109.5°
C15C17C42112.4°109.5°
C17C15H10106.2°109.5°
C15C17H17108.7°109.5°
C15C17H170108.7°109.4°
C17C42C43118.9°117.5°
C17C42C44120.0°117.5°
C42C17H17108.7°109.5°
C42C17H170108.7°109.4°
C17C42H42115.1°115.6°
C42C43C4459.8°60.0°
C43C42C4460.3°60.0°
C43C42H42115.8°117.5°
C42C43H43B120.0°117.5°
C42C43H43A120.0°117.5°
C43C44C4259.9°60.0°
C44C43H43B120.0°117.5°
C44C43H43A120.0°117.5°
C43C44H44B120.0°117.5°
C43C44H44A120.0°117.5°
C9N8C7108.8°108.7°
C9N8H7125.6°125.7°
N8C7C6130.5°133.1°
N8C7C11107.6°107.4°
C7N8H7125.6°125.6°
C7C6C5118.2°120.1°
C6C7C11121.9°119.5°
C7C6H6120.9°119.9°
C6C5C4121.2°120.7°
C6C5H5119.3°119.7°
C5C6H6120.9°119.9°
C5C4C3120.3°120.4°
C5C4H4119.9°119.8°
C4C5H5119.4°119.6°
C3C4H4119.9°119.8°
C44C42H42115.9°117.5°
C42C44H44B120.0°117.5°
C42C44H44A120.0°117.5°
H17C17H170109.5°109.5°
H3C1H1109.5°109.4°
H3C1H2109.5°109.5°
H1C1H2109.5°109.5°
H34C34H340109.5°109.5°
H33C36H32109.5°109.5°
H40BC40H40A109.5°109.5°
H40BC40H40C109.5°109.4°
H40AC40H40C109.5°109.5°
H43BC43H43A109.5°115.6°
H44BC44H44A109.5°115.6°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C1O2C3C11176.9°179.7°
C1O2C3C43.1°0.0°
O2C1H3H1120.0°120.0°
O2C1H3H2120.0°120.0°
O2C1H1H2120.0°120.0°
O2C3C11C4179.9°179.7°
O2C3C11C103.4°0.4°
O2C3C4C5179.9°179.7°
O2C3C11C7179.8°179.7°
O2C3C4H40.1°0.0°
C3O2C1H3180.0°180.0°
C3O2C1H160.0°60.0°
C3O2C1H260.0°60.0°
C3C11C10C7176.8°179.9°
C3C11C10C9176.8°180.0°
C3C11C7N8177.5°180.0°
C3C11C7C60.1°0.0°
C11C3C4C50.0°0.0°
C11C3C4H4180.0°179.7°
C3C11C10H83.2°0.1°
C11C10C9H8180.0°179.9°
C11C10C9C12176.8°180.0°
C11C10C9N80.1°0.0°
C10C11C7N80.1°0.0°
C10C11C7C6177.5°180.0°
C10C11C3C4176.6°179.9°
C10C9C12N8176.6°180.0°
C10C9C12N142.5°180.0°
C10C9C12O13175.2°0.0°
C10C9N8C70.1°0.0°
C9C10C11C70.0°0.0°
C10C9N8H7179.9°179.9°
C9C12N14O13177.7°180.0°
C9C12N14C15178.7°180.0°
C12C9N8C7177.2°180.0°
C12C9C10H83.2°0.1°
C9C12N14H91.3°0.0°
C12C9N8H72.8°0.1°
C12N14C15H9180.0°180.0°
C12N14C15C2166.8°155.0°
C12N14C15C17164.2°85.0°
N14C12C9N8179.1°0.0°
C12N14C15H1049.2°35.0°
N14C15C21C17126.4°120.0°
N14C15C21H10116.5°120.0°
N14C15C21N23148.5°180.0°
N14C15C21O2231.4°0.0°
N14C15C17H10115.5°120.0°
N14C15C17C4261.7°65.0°
C15N14C12O133.7°0.0°
N14C15C17H1758.8°55.0°
N14C15C17H170177.9°175.0°
C15C21N23O22179.9°180.0°
C15C21N23C24174.4°180.0°
C21C15C17H10117.1°120.0°
C21C15C17C42171.0°175.0°
C21C15C17H1768.6°64.9°
C21C15C17H17050.5°55.1°
C21C15N14H9113.2°25.0°
C15C21N23H205.6°0.0°
C21N23C24H20180.0°180.0°
C21N23C24C26137.7°85.0°
C21N23C24C3497.4°155.0°
N23C21C15C1785.1°60.0°
N23C21C15H1032.0°60.0°
C21N23C24H2119.3°35.0°
N23C24C26C34121.7°120.0°
N23C24C26H21118.7°120.0°
N23C24C26N38152.2°0.0°
N23C24C34H21117.2°120.0°
N23C24C34C36156.2°65.0°
C24N23C21O225.5°0.0°
N23C24C26H2327.8°180.0°
N23C24C34H3435.7°55.0°
N23C24C34H34083.4°175.0°
C24C26N38H23180.0°180.0°
C26C24C34H21119.8°120.0°
C26C24C34C3680.8°175.0°
C26C24C34H34158.8°65.0°
C26C24C34H34039.6°55.0°
C26C24N23H2042.2°95.0°
C24C26N38H38180.0°180.0°
N38C26C24C3486.1°120.0°
N38C26C24H2133.5°120.0°
C24C34C36H34120.4°120.0°
C24C34C36H340120.4°120.0°
C24C34C36S37166.2°180.0°
C34C24C26H2393.8°60.0°
C24C34H34H340118.8°120.0°
C24C34C36H3373.4°60.0°
C24C34C36H3245.8°60.0°
C34C24N23H2082.6°25.1°
C34C36S37H33120.4°120.0°
C34C36S37H32120.4°120.0°
C34C36S37O39155.9°65.5°
C34C36S37C4088.3°180.0°
C34C36S37O4127.6°65.5°
C36C34C24H2139.0°55.0°
C36C34H34H340118.8°120.0°
C34C36H33H32118.7°120.0°
C36S37O39C40113.1°110.1°
C36S37O39O41122.8°125.0°
C36S37C40O41115.5°114.5°
S37C36C34H3445.8°60.0°
S37C36C34H34073.4°60.0°
S37C36H33H32118.7°120.0°
C36S37C40H40B180.0°60.0°
C36S37C40H40A60.0°180.0°
C36S37C40H40C60.0°59.9°
O39S37C40O41129.0°131.0°
O39S37C36H3335.5°174.5°
O39S37C36H3283.7°54.5°
O39S37C40H40B64.6°54.5°
O39S37C40H40A55.4°65.5°
O39S37C40H40C175.4°174.5°
C40S37C36H33151.3°60.0°
C40S37C36H3232.1°60.0°
S37C40H40BH40A120.0°120.0°
S37C40H40BH40C120.0°120.0°
S37C40H40AH40C120.0°120.1°
O41S37C36H3392.8°54.5°
O41S37C36H32148.0°174.4°
O41S37C40H40B64.5°174.5°
O41S37C40H40A175.5°65.6°
O41S37C40H40C55.6°54.5°
O22C21C15C1795.0°119.9°
O22C21C15H10147.9°120.0°
O22C21N23H20174.5°180.0°
C15C17C42H17120.5°120.1°
C15C17C42H170120.4°119.9°
C15C17C42C4364.9°174.9°
C15C17C42C44135.4°116.4°
C15C17H17H170118.6°120.0°
C15C17C42H4279.0°29.3°
C17C15N14H915.8°95.0°
C17C42C43C44110.0°107.5°
C17C42C43H42143.6°145.0°
C17C42C44H42145.4°145.0°
C42C17C15H1053.8°55.0°
C42C17H17H170118.7°120.0°
C17C42C43H43B0.6°0.0°
C17C42C43H43A140.6°145.1°
C17C42C44H44B1.1°145.0°
C17C42C44H44A142.3°0.1°
C42C43C44H43B109.4°107.5°
C42C43C44H43A109.4°107.5°
C43C42C44H42106.3°107.5°
C43C42C17H17174.6°65.0°
C43C42C17H17055.5°55.0°
C42C43H43BH43A144.8°145.7°
C43C42C44H44B109.4°107.5°
C43C42C44H44A109.5°107.4°
C44C43H43BH43A144.8°145.7°
C43C44H44BH44A144.8°145.6°
O13C12C9N81.4°180.0°
O13C12N14H9176.3°180.0°
C9N8C7H7180.0°179.9°
C9N8C7C6177.2°180.0°
C9N8C7C110.1°0.0°
N8C9C10H8179.9°179.9°
N8C7C6C11177.0°180.0°
N8C7C6C5176.9°179.9°
N8C7C6H63.1°0.1°
C7C6C5H6180.0°179.9°
C7C6C5C40.0°0.1°
C7C6C5H5179.9°180.0°
C6C7N8H72.8°0.0°
C6C5C4H5180.0°179.9°
C6C5C4C30.1°0.1°
C5C6C7C110.0°0.1°
C6C5C4H4179.9°179.7°
C5C4C3H4180.0°179.8°
C4C5C6H6179.9°180.0°
C4C3C11C70.1°0.0°
C3C4C5H5179.9°180.0°
C11C7C6H6180.0°179.9°
C7C11C10H8180.0°179.9°
C11C7N8H7179.9°180.0°
C44C42C17H17104.2°3.7°
C44C42C17H17014.9°123.7°
C42C44H44BH44A144.8°145.8°
H4C4C5H50.1°0.2°
H5C5C6H60.1°0.1°
H10C15C17H17174.3°175.0°
H10C15C17H17066.6°65.0°
H10C15N14H9130.8°145.0°
H17C17C42H4241.5°149.3°
H170C17C42H42160.6°90.7°
H21C24C26H23146.5°60.0°
H21C24C34H3481.4°175.0°
H21C24C34H340159.4°65.0°
H21C24N23H20160.7°145.0°
H23C26N38H380.1°0.0°
H3C1H1H2120.0°120.0°
H34C34C36H33166.2°180.0°
H34C34C36H3274.6°60.0°
H340C34C36H3347.0°60.0°
H340C34C36H32166.2°180.0°
H40BC40H40AH40C120.0°120.0°
H42C42C43H43B144.2°145.0°
H42C42C43H43A3.1°0.1°
H42C42C44H44B144.2°0.0°
H42C42C44H44A3.1°145.1°
H43BC43C44H44B0.0°145.0°
H43BC43C44H44A141.2°0.1°
H43AC43C44H44B141.1°0.0°
H43AC43C44H44A0.0°145.0°

248942

PDB entries from 2026-02-11

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