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CTJ

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
COdoub1.21Å1.22Å
CCAsing1.51Å1.50Å
CHsing1.08Å1.08Å
S1C2sing1.82Å1.77Å
S1C6sing1.82Å1.75Å
C2C3sing1.50Å1.52Å
C2H2sing1.09Å1.10Å
C2H2Asing1.09Å1.10Å
C3C4doub1.31Å1.34Å
C3C3'sing1.51Å1.51Å
C4N5sing1.39Å1.32Å
C4C4'sing1.47Å1.46Å
N5C6sing1.47Å1.45Å
N5HN5sing0.97Å1.00Å
C6CAsing1.53Å1.53Å
C6H6sing1.09Å1.10Å
CAN10sing1.47Å1.45Å
CAHAsing1.09Å1.10Å
N10C11sing1.35Å1.33Å
N10HN10sing0.97Å1.00Å
C11O12doub1.22Å1.22Å
C11C13sing1.48Å1.46Å
C13C14sing1.48Å1.49Å
C13N16doub1.30Å1.33Å
C14C15doub1.35Å1.40ÅAromatic
C14N19sing1.33Å1.36ÅAromatic
C15S16sing1.76Å1.74ÅAromatic
C15H15sing1.08Å1.08Å
N16O17sing1.42Å1.26Å
S16C17sing1.76Å1.74ÅAromatic
C17N18sing1.38Å1.36Å
C17N19doub1.30Å1.35ÅAromatic
O17C18sing1.43Å1.42Å
C18C19sing1.53Å1.52Å
C18C20sing1.53Å1.52Å
C18C21sing1.51Å1.52Å
N18HN18sing0.97Å1.00Å
N18HN1Asing0.97Å1.00Å
C19H19sing1.09Å1.10Å
C19H19Asing1.09Å1.10Å
C19H19Bsing1.09Å1.10Å
C20H20sing1.09Å1.10Å
C20H20Asing1.09Å1.10Å
C20H20Bsing1.09Å1.10Å
C21O2Asing1.34Å1.25Å
C21O2Bdoub1.21Å1.25Å
O2AHO2Asing0.97Å0.95Å
C3'H3'sing1.09Å1.10Å
C3'H3'Asing1.09Å1.10Å
C4'O4Asing1.35Å1.26Å
C4'O4Bdoub1.22Å1.24Å
O4AHO4Asing0.97Å0.95Å
C3'N6sing1.46Å1.54Å
N6C26doub1.32Å1.54ÅAromatic
N6C22sing1.32Å1.54ÅAromatic
C26C25sing1.38Å1.54ÅAromatic
C25C24doub1.39Å1.54ÅAromatic
C24C23sing1.39Å1.54ÅAromatic
C23C22doub1.38Å1.54ÅAromatic
C26H26sing1.08Å1.08Å
C25H25sing1.08Å1.08Å
C24H24sing1.08Å1.08Å
C23H23sing1.08Å1.08Å
C22H22sing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
OCCA119.9°120.0°
OCH120.0°120.0°
CACH120.0°120.0°
CCAC6108.4°109.5°
CCAN10107.8°109.5°
CCAHA112.7°109.4°
C2S1C695.9°101.3°
S1C2C3115.4°109.4°
S1C2H2107.5°109.5°
S1C2H2A107.5°109.5°
S1C6N5105.3°107.2°
S1C6CA114.3°109.9°
S1C6H6109.1°110.0°
C3C2H2107.6°109.5°
C3C2H2A107.6°109.5°
C2C3C4121.9°125.7°
C2C3C3'117.4°117.2°
H2C2H2A111.3°109.5°
C4C3C3'120.7°117.1°
C3C4N5118.7°127.2°
C3C4C4'124.2°116.4°
C3C3'H3'104.3°109.4°
C3C3'H3'A104.2°109.4°
C3C3'N6126.2°109.4°
N5C4C4'117.0°116.3°
C4N5C6116.7°120.9°
C4N5HN5107.1°119.5°
C4C4'O4A121.3°120.0°
C4C4'O4B116.5°120.0°
C6N5HN5107.1°119.6°
N5C6CA109.3°109.9°
N5C6H6114.1°109.9°
CAC6H6105.0°110.0°
C6CAN10113.5°109.5°
C6CAHA107.0°109.5°
N10CAHA107.6°109.4°
CAN10C11123.1°120.0°
CAN10HN10118.5°119.9°
C11N10HN10118.4°120.1°
N10C11O12124.1°120.0°
N10C11C13114.5°120.0°
O12C11C13121.4°120.0°
C11C13C14118.9°120.0°
C11C13N16119.0°120.0°
C14C13N16122.0°120.0°
C13C14C15123.7°122.4°
C13C14N19125.2°122.4°
C13N16O17119.7°120.0°
C15C14N19111.1°115.2°
C14C15S16115.4°108.3°
C14C15H15122.3°125.9°
C14N19C17110.9°116.9°
S16C15H15122.3°125.8°
C15S16C1784.8°90.1°
N16O17C18121.6°114.0°
S16C17N18120.7°125.3°
S16C17N19117.7°109.5°
N18C17N19121.5°125.2°
C17N18HN18109.5°120.0°
C17N18HN1A109.5°120.1°
O17C18C19108.1°109.5°
O17C18C20108.6°109.5°
O17C18C21110.5°109.5°
C19C18C20110.6°109.4°
C19C18C21108.6°109.5°
C18C19H19109.5°109.5°
C18C19H19A109.5°109.5°
C18C19H19B109.4°109.5°
C20C18C21110.4°109.5°
C18C20H20109.5°109.5°
C18C20H20A109.5°109.5°
C18C20H20B109.5°109.5°
C18C21O2A119.1°120.0°
C18C21O2B118.8°120.0°
HN18N18HN1A109.4°120.0°
H19C19H19A109.5°109.5°
H19C19H19B109.5°109.4°
H19AC19H19B109.5°109.4°
H20C20H20A109.5°109.4°
H20C20H20B109.4°109.4°
H20AC20H20B109.5°109.5°
O2AC21O2B122.1°120.0°
C21O2AHO2A109.5°117.0°
H3'C3'H3'A114.1°109.5°
H3'C3'N6104.2°109.5°
H3'AC3'N6104.3°109.5°
O4AC4'O4B122.2°120.0°
C4'O4AHO4A109.5°117.0°
C3'N6C26135.0°119.1°
C3'N6C22105.0°119.1°
C26N6C22120.1°121.8°
N6C26C25120.0°120.8°
N6C26H26120.0°119.7°
N6C22C23120.0°120.7°
N6C22H22120.0°119.6°
C26C25C24120.0°119.2°
C25C26H26120.0°119.6°
C26C25H25120.0°120.4°
C25C24C23120.0°118.4°
C24C25H25120.0°120.4°
C25C24H24120.0°120.8°
C24C23C22120.0°119.2°
C23C24H24120.0°120.8°
C24C23H23120.0°120.4°
C22C23H23120.0°120.4°
C23C22H22120.0°119.6°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
OCCAH180.0°179.6°
OCCAC6109.4°119.9°
OCCAN1013.8°0.1°
OCCAHA132.4°120.1°
CCAC6S1166.5°60.0°
CCAC6N548.9°57.7°
CCAC6N10119.7°120.0°
CCAC6HA121.8°120.0°
CCAC6H674.0°178.8°
CCAN10HA121.8°119.9°
CCAN10C11146.2°84.9°
CCAN10HN1033.8°95.0°
HCCAC670.6°59.7°
HCCAN10166.2°179.7°
HCCAHA47.6°60.3°
S1C2C3H2120.0°120.0°
S1C2C3H2A120.0°120.0°
S1C2H2H2A117.5°120.1°
S1C2C3C424.7°21.3°
S1C2C3C3'156.1°158.7°
C2S1C6N560.6°56.3°
C2S1C6CA179.4°175.7°
C2S1C6H662.2°63.1°
C6S1C2C340.6°45.2°
C6S1C2H279.4°74.8°
C6S1C2H2A160.6°165.1°
S1C6N5C474.0°44.8°
S1C6N5CA123.2°119.4°
S1C6N5H6119.6°119.4°
S1C6N5HN5166.0°135.3°
S1C6CAH6119.5°121.2°
S1C6CAN1046.9°60.0°
S1C6CAHA71.6°180.0°
C3C2H2H2A117.6°120.0°
C2C3C4C3'179.2°179.9°
C2C3C4N524.2°1.0°
C2C3C4C4'153.1°179.1°
C2C3C3'H3'146.4°156.1°
C2C3C3'H3'A93.6°36.1°
C2C3C3'N626.4°83.9°
H2C2C3C495.3°98.6°
H2C2C3C3'83.9°81.3°
H2AC2C3C4144.7°141.3°
H2AC2C3C3'36.2°38.8°
C3C4N5C4'177.5°179.9°
C3C4N5C651.7°14.9°
C3C4N5HN5171.7°165.2°
C4C3C3'H3'34.4°23.8°
C4C3C3'H3'A85.6°143.8°
C3C4C4'O4A72.1°74.7°
C3C4C4'O4B108.6°105.2°
C4C3C3'N6154.4°96.2°
C3'C3C4N5156.7°179.1°
C3'C3C4C4'26.0°0.8°
C3C3'H3'H3'A113.1°119.9°
C3C3'H3'N6133.8°120.0°
C3C3'H3'AN6133.8°120.0°
C3C3'N6C26176.3°96.6°
C3C3'N6C223.7°83.7°
C4N5C6HN5120.0°179.9°
C4N5C6CA162.7°164.2°
C4N5C6H645.5°74.7°
N5C4C4'O4A110.6°105.4°
N5C4C4'O4B68.7°74.7°
C4'C4N5C6125.8°165.2°
C4'C4N5HN55.8°14.7°
C4C4'O4AO4B179.3°179.9°
C4C4'O4AHO4A179.3°180.0°
N5C6CAH6122.8°121.1°
N5C6CAN1070.8°177.8°
N5C6CAHA170.7°62.3°
HN5N5C6CA42.7°15.9°
HN5N5C6H674.5°105.2°
C6CAN10HA118.1°120.0°
C6CAN10C1193.7°155.0°
C6CAN10HN1086.3°25.1°
H6C6CAN10166.4°61.2°
H6C6CAHA47.9°58.8°
CAN10C11HN10180.0°179.9°
CAN10C11O122.3°5.1°
CAN10C11C13177.6°174.9°
HACAN10C1124.4°35.0°
HACAN10HN10155.6°145.1°
N10C11O12C13180.0°180.0°
N10C11C13C1478.4°5.4°
N10C11C13N16101.7°174.6°
HN10N10C11O12177.7°174.8°
HN10N10C11C132.4°5.2°
O12C11C13C14101.6°174.7°
O12C11C13N1678.3°5.3°
C11C13C14N16179.9°180.0°
C11C13C14C152.2°173.7°
C11C13C14N19176.9°6.1°
C11C13N16O170.6°5.5°
C13C14C15N19179.2°179.8°
C13C14C15S16179.4°180.0°
C13C14C15H150.6°0.1°
C14C13N16O17179.3°174.5°
C13C14N19C17179.6°179.7°
N16C13C14C15177.9°6.3°
N16C13C14N193.0°173.9°
C13N16O17C18179.0°180.0°
C14C15S16H15180.0°180.0°
C14C15S16C170.0°0.0°
C15C14N19C170.4°0.4°
N19C14C15S160.2°0.2°
N19C14C15H15179.8°179.8°
C14N19C17S160.5°0.5°
C14N19C17N18179.6°179.8°
C15S16C17N18179.8°180.0°
C15S16C17N190.3°0.3°
H15C15S16C17180.0°180.0°
N16O17C18C19169.5°60.0°
N16O17C18C2070.4°60.0°
N16O17C18C2150.9°180.0°
S16C17N18N19179.9°179.7°
S16C17N18HN180.0°0.1°
S16C17N18HN1A120.0°180.0°
C17N18HN18HN1A120.0°180.0°
N19C17N18HN18179.9°179.8°
N19C17N18HN1A60.1°0.3°
O17C18C19C20118.8°120.0°
O17C18C19C21119.9°120.0°
O17C18C20C21121.2°120.0°
O17C18C19H19180.0°60.0°
O17C18C19H19A60.0°180.0°
O17C18C19H19B60.0°60.0°
O17C18C20H20180.0°60.0°
O17C18C20H20A60.0°180.0°
O17C18C20H20B60.0°60.0°
O17C18C21O2A33.3°180.0°
O17C18C21O2B147.0°0.1°
C19C18C20C21120.3°120.0°
C18C19H19H19A120.0°120.0°
C18C19H19H19B120.0°120.0°
C18C19H19AH19B120.0°120.0°
C19C18C20H2061.5°180.0°
C19C18C20H20A178.5°60.0°
C19C18C20H20B58.5°60.0°
C19C18C21O2A85.1°60.0°
C19C18C21O2B94.6°120.0°
C20C18C19H1961.3°60.0°
C20C18C19H19A58.8°60.0°
C20C18C19H19B178.7°180.0°
C18C20H20H20A120.0°120.0°
C18C20H20H20B120.0°120.0°
C18C20H20AH20B120.0°120.1°
C20C18C21O2A153.4°60.0°
C20C18C21O2B26.8°120.1°
C21C18C19H1960.1°180.0°
C21C18C19H19A179.9°60.0°
C21C18C19H19B59.9°60.0°
C21C18C20H2058.8°60.0°
C21C18C20H20A61.2°60.0°
C21C18C20H20B178.8°180.0°
C18C21O2AO2B179.8°179.9°
C18C21O2AHO2A179.8°180.0°
H19C19H19AH19B120.0°120.0°
H20C20H20AH20B120.0°119.9°
O2BC21O2AHO2A0.0°0.1°
H3'C3'H3'AN6113.1°120.1°
H3'C3'N6C2663.7°23.4°
H3'C3'N6C22116.3°156.3°
H3'AC3'N6C2656.3°143.5°
H3'AC3'N6C22123.7°36.2°
O4BC4'O4AHO4A0.0°0.1°
C3'N6C26C22180.0°179.7°
C3'N6C26C25180.0°180.0°
C3'N6C22C23180.0°179.8°
C3'N6C26H260.0°0.1°
C3'N6C22H220.0°0.1°
N6C26C25H26180.0°180.0°
N6C26C25C240.0°0.0°
C26N6C22C230.0°0.5°
N6C26C25H25180.0°179.9°
C26N6C22H22180.0°179.7°
C22N6C26C250.0°0.3°
N6C22C23C240.0°0.5°
N6C22C23H22180.0°179.8°
C22N6C26H26180.0°179.7°
N6C22C23H23180.0°179.7°
C26C25C24H25180.0°180.0°
C26C25C24C230.0°0.0°
C26C25C24H24180.0°180.0°
C25C24C23H24180.0°180.0°
C25C24C23C220.0°0.2°
C24C25C26H26180.0°180.0°
C25C24C23H23180.0°179.9°
C24C23C22H23180.0°179.9°
C23C24C25H25180.0°180.0°
C24C23C22H22180.0°179.8°
C22C23C24H24180.0°179.8°
H26C26C25H250.0°0.0°
H25C25C24H240.0°0.0°
H24C24C23H230.0°0.0°
H23C23C22H220.0°0.1°

225946

PDB entries from 2024-10-09

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