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WS3

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
O22C22sing1.43Å1.44Å
O33C33sing1.43Å1.43Å
C22C33sing1.54Å1.51Å
C22C11sing1.55Å1.53Å
C33C44sing1.55Å1.53Å
C44C55sing1.53Å1.53Å
C44O44sing1.44Å1.43Å
O6'C6'sing1.43Å1.44Å
O13C12doub1.21Å1.23Å
C55N11sing1.47Å1.45Å
C6'C5'sing1.53Å1.53Å
O44C11sing1.44Å1.43Å
C11N1sing1.47Å1.48Å
C12N11sing1.35Å1.33Å
C12C14sing1.48Å1.50Å
O2C2doub1.22Å1.24Å
C5'O5'sing1.43Å1.43Å
C5'C4'sing1.53Å1.52Å
N1C2sing1.35Å1.42Å
N1C6sing1.37Å1.35Å
C2N3sing1.35Å1.34Å
O5'C1'sing1.43Å1.44Å
N19C14doub1.33Å1.36ÅAromatic
N19C18sing1.32Å1.35ÅAromatic
C14C15sing1.39Å1.40ÅAromatic
O4'C4'sing1.43Å1.43Å
C4'C3'sing1.53Å1.52Å
C6C5doub1.35Å1.40Å
C20C18sing1.51Å1.52Å
C20O1'sing1.43Å1.42Å
C18C17doub1.39Å1.40ÅAromatic
N3C4sing1.35Å1.34Å
C1'O1'sing1.43Å1.43Å
C1'C2'sing1.53Å1.53Å
C15C16doub1.39Å1.40ÅAromatic
C3'C2'sing1.53Å1.52Å
C3'O3'sing1.43Å1.43Å
C5C4sing1.42Å1.40Å
C4O4doub1.22Å1.25Å
C2'O2'sing1.43Å1.43Å
C17C16sing1.39Å1.40ÅAromatic
N3H1sing0.97Å1.00Å
C5H2sing1.08Å1.08Å
C6H3sing1.08Å1.08Å
C11H4sing1.09Å1.10Å
C22H5sing1.09Å1.10Å
O22H6sing0.97Å0.95Å
C33H7sing1.09Å1.10Å
O33H8sing0.97Å0.95Å
C44H9sing1.09Å1.10Å
C55H10sing1.09Å1.10Å
C55H11sing1.09Å1.10Å
N11H12sing0.97Å1.00Å
C15H13sing1.08Å1.08Å
C16H14sing1.08Å1.08Å
C17H15sing1.08Å1.08Å
C20H16sing1.09Å1.10Å
C20H17sing1.09Å1.10Å
C1'H18sing1.09Å1.10Å
C5'H19sing1.09Å1.10Å
C6'H20sing1.09Å1.10Å
C6'H21sing1.09Å1.10Å
O6'H22sing0.97Å0.95Å
C4'H23sing1.09Å1.10Å
O4'H24sing0.97Å0.95Å
C3'H25sing1.09Å1.10Å
O3'H26sing0.97Å0.95Å
C2'H27sing1.09Å1.10Å
O2'H28sing0.97Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
O22C22C33108.2°110.5°
O22C22C11111.6°110.6°
O22C22H5112.2°110.5°
C22O22H6109.5°114.0°
O33C33C22110.5°110.5°
O33C33C44113.5°110.5°
O33C33H7111.0°110.6°
C33O33H8109.5°114.0°
C33C22C11102.3°104.1°
C22C33C44102.0°104.0°
C33C22H5111.2°110.5°
C22C33H7109.9°110.5°
C22C11O44106.8°104.9°
C22C11N1111.9°110.4°
C22C11H4108.5°110.4°
C11C22H5110.9°110.5°
C33C44C55116.6°110.4°
C33C44O44104.6°104.8°
C44C33H7109.6°110.5°
C33C44H9108.0°110.4°
C55C44O44110.1°110.4°
C44C55N11112.4°109.5°
C55C44H9108.0°110.3°
C44C55H10108.7°109.5°
C44C55H11108.7°109.5°
C44O44C11109.6°105.3°
O44C44H9109.3°110.5°
O6'C6'C5'110.9°109.5°
O6'C6'H20109.1°109.5°
O6'C6'H21109.1°109.5°
C6'O6'H22109.5°114.0°
O13C12N11121.8°120.0°
O13C12C14119.1°120.0°
C55N11C12121.1°120.0°
N11C55H10108.7°109.4°
N11C55H11108.8°109.4°
C55N11H12119.5°120.0°
C6'C5'O5'107.4°109.5°
C6'C5'C4'110.2°109.5°
C6'C5'H19108.8°109.5°
C5'C6'H20109.1°109.5°
C5'C6'H21109.1°109.5°
O44C11N1110.5°110.4°
O44C11H4109.8°110.4°
C11N1C2119.4°119.7°
C11N1C6122.1°119.7°
N1C11H4109.2°110.3°
N11C12C14119.1°120.0°
C12N11H12119.4°120.0°
C12C14N19118.6°119.7°
C12C14C15121.0°119.7°
O2C2N1119.5°119.5°
O2C2N3119.5°119.5°
O5'C5'C4'111.4°109.4°
C5'O5'C1'120.3°114.1°
O5'C5'H19110.1°109.5°
C5'C4'O4'109.3°109.5°
C5'C4'C3'109.6°109.2°
C4'C5'H19108.9°109.5°
C5'C4'H23109.0°109.6°
C2N1C6118.5°120.6°
N1C2N3121.0°121.0°
N1C6C5120.3°119.7°
N1C6H3119.9°120.2°
C2N3C4120.9°120.3°
C2N3H1119.5°119.9°
O5'C1'O1'112.8°109.5°
O5'C1'C2'115.2°109.4°
O5'C1'H18106.4°109.5°
C14N19C18121.5°121.6°
N19C14C15120.3°120.5°
N19C18C20119.4°119.5°
N19C18C17119.9°120.9°
C14C15C16119.3°119.1°
C14C15H13120.4°120.4°
O4'C4'C3'109.7°109.5°
O4'C4'H23110.1°109.6°
C4'O4'H24109.5°114.0°
C4'C3'C2'109.8°109.0°
C4'C3'O3'109.7°109.5°
C3'C4'H23109.0°109.5°
C4'C3'H25109.3°109.5°
C6C5C4119.4°119.0°
C6C5H2120.3°120.5°
C5C6H3119.9°120.1°
C18C20O1'109.0°109.5°
C20C18C17120.7°119.5°
C18C20H16109.6°109.5°
C18C20H17109.6°109.5°
C20O1'C1'115.0°114.0°
O1'C20H16109.6°109.4°
O1'C20H17109.6°109.5°
C18C17C16119.8°119.3°
C18C17H15120.1°120.3°
N3C4C5119.9°119.4°
N3C4O4119.3°120.4°
C4N3H1119.5°119.9°
O1'C1'C2'110.0°109.5°
O1'C1'H18106.4°109.5°
C1'C2'C3'113.6°109.2°
C1'C2'O2'108.4°109.5°
C2'C1'H18105.4°109.5°
C1'C2'H27108.0°109.5°
C15C16C17119.2°118.5°
C16C15H13120.3°120.5°
C15C16H14120.4°120.7°
C2'C3'O3'108.3°109.6°
C3'C2'O2'109.3°109.5°
C2'C3'H25109.2°109.6°
C3'C2'H27108.1°109.5°
O3'C3'H25110.5°109.6°
C3'O3'H26109.5°114.0°
C5C4O4120.8°120.2°
C4C5H2120.3°120.5°
O2'C2'H27109.3°109.5°
C2'O2'H28109.5°114.0°
C17C16H14120.4°120.8°
C16C17H15120.1°120.3°
H10C55H11109.4°109.5°
H16C20H17109.5°109.5°
H20C6'H21109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
O22C22C33O3339.1°0.1°
O22C22C33C11117.9°118.7°
O22C22C33H5123.7°122.7°
O22C22C11H5125.9°122.7°
O22C22C33C4481.8°118.7°
O22C22C11O4491.5°142.6°
O22C22C11N1147.5°98.5°
O22C22C11H426.9°23.6°
O22C22C33H7161.9°122.7°
O33C33C22C44121.0°118.6°
O33C33C22H7122.8°122.7°
O33C33C22C11157.0°118.6°
O33C33C44H7124.7°122.7°
O33C33C44C5582.7°98.6°
O33C33C44O44155.4°142.6°
O33C33C22H584.6°122.7°
O33C33C44H939.1°23.6°
C33C22C11H5118.7°118.7°
C22C33C44H7116.4°118.7°
C22C33C44C55158.4°142.8°
C22C33C44O4436.5°23.9°
C33C22C11O4423.9°23.9°
C33C22C11N197.1°142.8°
C33C22C11H4142.3°95.0°
C33C22O22H6180.0°61.5°
C22C33O33H8165.8°61.5°
C22C33C44H979.8°95.0°
C11C22C33C4436.0°0.0°
C22C11O44C441.1°40.4°
C22C11O44N1121.9°118.9°
C22C11O44H4117.5°118.9°
C22C11N1H4120.2°122.2°
C22C11N1C271.2°116.5°
C22C11N1C6109.8°63.1°
C11C22O22H668.2°176.1°
C11C22C33H780.2°118.6°
C33C44C55O44119.0°115.4°
C33C44C55H9121.8°122.2°
C33C44O44H9115.5°118.9°
C33C44C55N1141.8°175.0°
C33C44O44C1122.1°40.4°
C44C33C22H5154.5°118.7°
C44C33O33H880.3°176.1°
C33C44C55H10162.3°55.0°
C33C44C55H1178.6°65.0°
C55C44O44H9118.4°122.3°
C44C55N11H10120.4°120.0°
C44C55N11H11120.5°120.0°
C55C44O44C11148.2°159.3°
C44C55N11C1294.1°180.0°
C55C44C33H742.0°24.2°
C44C55H10H11118.7°120.1°
C44C55N11H1285.9°0.0°
O44C44C55N1177.2°69.6°
C44O44C11N1120.8°159.3°
C44O44C11H4118.6°78.4°
O44C44C33H779.9°94.7°
O44C44C55H1043.3°170.4°
O44C44C55H11162.4°50.4°
O6'C6'C5'H20120.2°120.0°
O6'C6'C5'H21120.2°120.0°
O6'C6'C5'O5'147.0°65.0°
O6'C6'C5'C4'25.5°175.0°
O6'C6'C5'H1993.9°55.0°
O6'C6'H20H21119.3°120.0°
O13C12N11C5514.2°0.0°
O13C12N11C14179.7°180.0°
O13C12C14N190.6°179.7°
O13C12C14C15179.4°0.0°
O13C12N11H12165.8°180.0°
C55N11C12H12180.0°179.9°
C55N11C12C14166.1°180.0°
N11C55C44H9163.6°52.7°
N11C55H10H11118.7°119.9°
C6'C5'O5'C4'120.8°120.0°
C6'C5'O5'H19118.3°120.1°
C6'C5'C4'H19119.3°120.1°
C6'C5'O5'C1'165.6°178.9°
C6'C5'C4'O4'55.8°57.7°
C6'C5'C4'C3'176.2°177.6°
C5'C6'H20H21119.3°120.1°
C5'C6'O6'H22180.0°180.0°
C6'C5'C4'H2364.6°62.5°
O44C11N1H4121.0°122.3°
O44C11N1C2169.9°128.0°
O44C11N1C69.0°52.4°
O44C11C22H5142.6°94.7°
C11O44C44H993.3°78.5°
C11N1C2O20.6°0.0°
C11N1C2C6179.0°179.6°
C11N1C2N3179.5°180.0°
C11N1C6C5179.6°180.0°
C11N1C6H30.4°0.1°
N1C11C22H521.6°24.2°
N11C12C14N19179.7°0.3°
N11C12C14C150.3°180.0°
C12N11C55H10145.4°60.0°
C12N11C55H1126.3°59.9°
C12C14N19C15180.0°179.7°
C12C14N19C18179.9°179.8°
C12C14C15C16179.9°180.0°
C14C12N11H1214.0°0.0°
C12C14C15H130.1°0.0°
O2C2N1N3179.9°180.0°
O2C2N1C6179.6°179.7°
O2C2N3C4179.6°180.0°
O2C2N3H10.4°0.1°
O5'C5'C4'H19121.6°119.9°
O5'C5'C4'O4'63.2°62.3°
O5'C5'C4'C3'57.1°57.6°
C5'O5'C1'O1'93.4°58.8°
C5'O5'C1'C2'34.1°61.2°
C5'O5'C1'H18150.4°178.9°
O5'C5'C6'H2092.8°175.0°
O5'C5'C6'H2126.7°55.0°
O5'C5'C4'H23176.3°177.5°
C4'C5'O5'C1'44.8°61.2°
C5'C4'O4'C3'120.3°119.7°
C5'C4'O4'H23119.7°120.2°
C5'C4'C3'H23119.2°120.0°
C5'C4'C3'C2'60.4°56.9°
C5'C4'C3'O3'179.3°176.9°
C4'C5'C6'H20145.7°55.1°
C4'C5'C6'H2194.8°65.0°
C5'C4'O4'H24180.0°179.9°
C5'C4'C3'H2559.4°62.9°
C2N1C6C50.7°0.4°
N1C2N3C40.5°0.0°
N1C2N3H1179.5°179.9°
C2N1C6H3179.4°179.7°
C2N1C11H448.9°5.7°
C6N1C2N30.5°0.4°
N1C6C5H3180.0°179.9°
N1C6C5C40.8°0.1°
N1C6C5H2179.2°180.0°
C6N1C11H4130.0°174.7°
C2N3C4H1180.0°179.9°
C2N3C4C50.6°0.3°
C2N3C4O4180.0°180.0°
O5'C1'O1'C2027.5°70.0°
O5'C1'O1'C2'130.1°119.9°
O5'C1'O1'H18116.2°120.0°
O5'C1'C2'H18116.9°120.0°
O5'C1'C2'C3'35.7°57.6°
O5'C1'C2'O2'157.4°177.6°
C1'O5'C5'H1976.1°58.8°
O5'C1'C2'H2784.3°62.3°
C14N19C18C20179.9°179.7°
C14N19C18C170.1°0.5°
N19C14C15C160.0°0.2°
N19C14C15H13180.0°179.7°
C18N19C14C150.1°0.5°
N19C18C20C17179.8°179.8°
N19C18C20O1'140.1°179.7°
N19C18C17C160.1°0.2°
N19C18C17H15179.9°179.7°
N19C18C20H1620.1°59.8°
N19C18C20H17100.0°60.2°
C14C15C16H13180.0°180.0°
C14C15C16C170.0°0.0°
C14C15C16H14180.0°180.0°
O4'C4'C3'H23120.7°120.2°
O4'C4'C3'C2'59.7°63.0°
O4'C4'C3'O3'59.2°57.0°
O4'C4'C5'H19175.1°177.7°
O4'C4'C3'H25179.5°177.2°
C4'C3'C2'C1'49.7°57.0°
C4'C3'C2'O3'119.7°119.9°
C4'C3'C2'H25119.8°119.8°
C4'C3'O3'H25120.6°120.1°
C4'C3'C2'O2'171.0°176.9°
C3'C4'C5'H1964.5°62.4°
C3'C4'O4'H2459.7°60.3°
C4'C3'O3'H26180.0°180.0°
C4'C3'C2'H2770.2°63.0°
C6C5C4N30.7°0.2°
C6C5C4H2180.0°180.0°
C6C5C4O4179.8°180.0°
C18C20O1'H16119.9°120.0°
C18C20O1'H17119.9°120.1°
C18C20O1'C1'160.4°180.0°
C20C18C17C16179.9°180.0°
C20C18C17H150.1°0.0°
C18C20H16H17120.2°120.0°
O1'C20C18C1740.1°0.0°
C20O1'C1'C2'102.6°170.1°
O1'C20H16H17120.2°120.0°
C20O1'C1'H18143.8°50.0°
C18C17C16C150.1°0.0°
C18C17C16H15180.0°179.9°
C18C17C16H14179.9°180.0°
C17C18C20H16160.1°120.0°
C17C18C20H1779.8°120.0°
N3C4C5O4179.5°179.7°
N3C4C5H2179.3°179.7°
O1'C1'C2'H18114.3°120.1°
O1'C1'C2'C3'93.1°62.3°
O1'C1'C2'O2'28.6°57.6°
C1'O1'C20H1640.4°60.0°
C1'O1'C20H1779.7°60.0°
O1'C1'C2'H27146.9°177.7°
C1'C2'C3'O2'121.3°119.9°
C1'C2'C3'H27119.9°120.0°
C1'C2'C3'O3'169.5°176.9°
C1'C2'O2'H27117.5°120.1°
C1'C2'C3'H2570.1°62.8°
C1'C2'O2'H28180.0°60.0°
C15C16C17H14180.0°180.0°
C15C16C17H15180.0°180.0°
C2'C3'O3'H25119.6°120.3°
C3'C2'O2'H27118.2°120.2°
C3'C2'C1'H18152.6°177.6°
C2'C3'C4'H23179.6°176.9°
C2'C3'O3'H2660.2°60.4°
C3'C2'O2'H2855.6°179.7°
O3'C3'C2'O2'69.3°63.2°
O3'C3'C4'H2361.5°63.2°
O3'C3'C2'H2749.6°56.9°
C5C4N3H1179.4°179.8°
C4C5C6H3179.3°180.0°
O4C4N3H10.0°0.1°
O4C4C5H20.2°0.0°
O2'C2'C1'H1885.7°62.5°
O2'C2'C3'H2551.2°57.1°
C17C16C15H13180.0°180.0°
H2C5C6H30.7°0.1°
H4C11C22H599.0°146.3°
H5C22O22H656.9°61.2°
H5C22C33H738.2°0.0°
H7C33O33H843.7°61.3°
H7C33C44H9163.7°146.3°
H9C44C55H1075.9°67.2°
H9C44C55H1143.2°172.7°
H10C55N11H1234.6°120.1°
H11C55N11H12153.7°120.0°
H13C15C16H140.0°0.0°
H14C16C17H150.0°0.0°
H18C1'C2'H2732.6°57.6°
H19C5'C6'H2026.3°64.9°
H19C5'C6'H21145.9°175.0°
H19C5'C4'H2354.7°57.5°
H20C6'O6'H2259.8°60.0°
H21C6'O6'H2259.7°60.0°
H23C4'O4'H2460.3°59.9°
H23C4'C3'H2559.8°57.0°
H25C3'O3'H2659.4°59.9°
H25C3'C2'H27170.0°177.2°
H27C2'O2'H2862.5°60.2°

222926

PDB entries from 2024-07-24

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