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NC1

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
S1C2sing1.82Å1.83Å
S1C6sing1.82Å1.80Å
C2N3sing1.45Å1.46Å
C2C9sing1.52Å1.58Å
C2H9sing1.09Å1.11Å
N3C4sing1.38Å1.38Å
N3H8sing1.02Å1.02Å
C4C5doub1.35Å1.54Å
C4C19sing1.53Å1.54Å
C5C6sing1.52Å1.51Å
C5C22sing1.45Å1.47Å
C6H6sing1.10Å1.12Å
C6H7sing1.10Å1.12Å
C7O8doub1.23Å1.26Å
C7C9sing1.52Å1.55Å
C7OGsing1.36Å1.37Å
C9N10sing1.44Å1.50Å
C9H10sing1.09Å1.12Å
N10C11sing1.39Å1.45Å
N10H11sing1.02Å1.02Å
C11O12doub1.23Å1.25Å
C11C13sing1.52Å1.52Å
C13C14sing1.51Å1.49Å
C13H12sing1.10Å1.12Å
C13H13sing1.10Å1.12Å
C14S15sing1.70Å1.66ÅAromatic
C14C18doub1.36Å1.48ÅAromatic
S15C16sing1.71Å1.71ÅAromatic
C16C17doub1.38Å1.36ÅAromatic
C16H14sing1.08Å1.10Å
C17C18sing1.42Å1.41ÅAromatic
C17H15sing1.08Å1.10Å
C18H16sing1.08Å1.10Å
C19O20doub1.26Å1.25Å
C19O21sing1.26Å1.22Å
C22C23doub1.33Å1.35Å
C22H5sing1.08Å1.10Å
C23C24sing1.47Å1.48Å
C23H4sing1.09Å1.10Å
C24C25doub1.39Å1.41ÅAromatic
C24C29sing1.39Å1.49ÅAromatic
C25C26sing1.39Å1.48ÅAromatic
C25N30sing1.42Å1.35Å
C26C27doub1.40Å1.36ÅAromatic
C26H1sing1.09Å1.10Å
C27C28sing1.40Å1.49ÅAromatic
C27N33sing1.42Å1.34Å
C28C29doub1.39Å1.36ÅAromatic
C28HC28sing1.09Å1.10Å
C29H3sing1.09Å1.10Å
N30O31sing1.25Å1.47Å
N30O32doub1.25Å1.36Å
N33O34sing1.26Å1.50Å
N33O35doub1.25Å1.37Å
NCAsing1.45Å1.46Å
NHsing1.00Å1.02Å
NH2sing1.00Å1.02Å
CACBsing1.53Å1.53Å
CACsing1.54Å1.53Å
CAH19sing1.10Å1.12Å
CBOGsing1.43Å1.43Å
CBHB2sing1.10Å1.12Å
CBHB3sing1.10Å1.11Å
COdoub1.26Å1.24Å
COXTsing1.27Å90.83Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C2S1C6103.7°97.9°
S1C2N3115.0°110.8°
S1C2C9111.9°109.3°
S1C2H9103.7°108.5°
S1C6C5119.8°114.1°
S1C6H6108.5°106.0°
S1C6H7108.5°108.9°
N3C2C9109.6°109.8°
N3C2H9106.4°109.7°
C2N3C4129.4°125.7°
C2N3H8105.3°117.6°
C9C2H9109.9°108.8°
C2C9C7109.1°110.2°
C2C9N10112.2°109.9°
C2C9H10107.3°110.3°
C4N3H8105.3°115.8°
N3C4C5123.3°124.2°
N3C4C19113.7°114.8°
C5C4C19123.1°120.9°
C4C5C6118.3°122.4°
C4C5C22122.5°125.1°
C4C19O20123.2°114.3°
C4C19O21112.2°114.4°
C6C5C22119.2°112.5°
C5C6H6108.5°110.4°
C5C6H7108.5°109.9°
C5C22C23124.1°122.6°
C5C22H5122.6°114.6°
H6C6H7101.5°107.4°
O8C7C9122.2°122.7°
O8C7OG127.7°125.1°
C9C7OG110.1°112.2°
C7C9N10107.5°112.2°
C7C9H10112.0°107.5°
C7OGCB111.4°115.8°
N10C9H10108.8°106.6°
C9N10C11118.5°122.8°
C9N10H11122.4°118.6°
C11N10H11119.1°118.6°
N10C11O12123.6°124.8°
N10C11C13115.9°111.7°
O12C11C13120.5°123.5°
C11C13C14107.6°113.3°
C11C13H12112.9°108.8°
C11C13H13112.9°108.6°
C14C13H12112.9°109.6°
C14C13H13112.9°109.7°
C13C14S15119.0°118.7°
C13C14C18128.1°127.6°
H12C13H1397.6°106.6°
S15C14C18112.9°113.7°
C14S15C1693.9°91.0°
C14C18C17105.7°111.2°
C14C18H16128.9°124.4°
S15C16C17109.5°112.1°
S15C16H14134.5°120.4°
C17C16H14116.0°127.6°
C16C17C18118.1°112.0°
C16C17H15119.0°123.4°
C18C17H15122.9°124.5°
C17C18H16125.4°124.4°
O20C19O21124.6°131.3°
C23C22H5113.2°122.8°
C22C23C24121.3°124.6°
C22C23H4114.5°120.0°
C24C23H4124.2°115.5°
C23C24C25122.5°121.3°
C23C24C29118.7°117.7°
C25C24C29118.8°121.1°
C24C25C26118.9°119.4°
C24C25N30124.3°122.0°
C24C29C28120.9°119.5°
C24C29H3124.3°121.5°
C26C25N30116.8°118.6°
C25C26C27121.3°120.0°
C25C26H1123.8°120.1°
C25N30O31123.1°118.8°
C25N30O32119.4°118.8°
C27C26H1114.8°119.9°
C26C27C28119.7°120.0°
C26C27N33120.0°120.0°
C28C27N33120.3°120.0°
C27C28C29120.3°120.0°
C27C28HC28124.4°120.7°
C27N33O34120.3°119.0°
C27N33O35119.9°119.0°
C29C28HC28115.3°119.3°
C28C29H3114.8°119.0°
O31N30O32117.5°122.4°
O34N33O35119.8°122.0°
CANH112.0°118.8°
CANH2110.1°118.8°
NCACB110.1°110.2°
NCAC115.7°111.5°
NCAH19104.5°105.6°
HNH2112.0°121.1°
CBCAC109.2°115.8°
CBCAH19111.7°107.5°
CACBOG111.3°111.3°
CACBHB2111.5°111.5°
CACBHB3111.5°110.4°
CCAH19105.6°105.6°
CACO120.1°116.4°
CACOXT117.8°114.7°
OGCBHB2111.5°108.4°
OGCBHB3111.5°107.4°
HB2CBHB398.9°107.7°
OCOXT116.3°128.9°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
S1C2N3C9127.0°120.8°
S1C2N3H9114.2°119.7°
S1C2C9H9114.7°118.3°
S1C2N3C416.1°37.3°
S1C2N3H8109.2°153.3°
C2S1C6C535.8°46.6°
C2S1C6H689.5°168.2°
C2S1C6H7161.0°76.5°
S1C2C9C7156.7°178.3°
S1C2C9N1037.7°57.5°
S1C2C9H1081.8°59.8°
C6S1C2N330.7°51.1°
C6S1C2C995.1°172.1°
C6S1C2H9146.5°69.4°
S1C6C5C423.8°25.2°
S1C6C5H6125.3°119.2°
S1C6C5H7125.3°122.6°
S1C6C5C22155.2°155.4°
S1C6H6H7114.2°116.3°
N3C2C9H9116.5°120.0°
C2N3C4H8125.3°169.5°
C2N3C4C51.5°6.5°
C2N3C4C19178.6°173.3°
N3C2C9C727.9°60.0°
N3C2C9N1091.1°64.2°
N3C2C9H10149.4°178.5°
C9C2N3C4111.0°158.1°
C9C2N3H8123.8°32.6°
C2C9C7O8120.6°60.3°
C2C9C7N10121.9°122.9°
C2C9C7H10118.6°120.3°
C2C9C7OG59.8°119.2°
C2C9N10H10118.5°119.6°
C2C9N10C11110.2°149.6°
C2C9N10H1169.8°30.4°
H9C2N3C4130.3°82.4°
H9C2N3H85.0°86.9°
H9C2C9C788.6°60.0°
H9C2C9N10152.4°175.8°
H9C2C9H1032.9°58.5°
N3C4C5C19179.9°179.8°
N3C4C5C62.0°0.8°
N3C4C5C22177.0°178.5°
N3C4C19O20178.5°89.8°
N3C4C19O210.9°90.3°
H8N3C4C5126.8°176.0°
H8N3C4C1953.3°3.7°
C4C5C6C22179.0°179.4°
C4C5C6H6101.5°144.4°
C4C5C6H7149.1°97.4°
C5C4C19O201.4°90.0°
C5C4C19O21179.2°90.0°
C4C5C22C23178.1°180.0°
C4C5C22H51.9°0.7°
C19C4C5C6177.9°179.5°
C19C4C5C223.1°1.2°
C4C19O20O21179.4°180.0°
C5C6H6H7114.2°119.7°
C6C5C22C232.9°0.6°
C6C5C22H5177.1°178.7°
C22C5C6H679.5°36.2°
C22C5C6H730.0°82.0°
C5C22C23H5180.0°179.2°
C5C22C23C24172.6°179.5°
C5C22C23H47.4°0.7°
O8C7C9OG179.7°179.5°
O8C7C9N101.3°176.8°
O8C7C9H10120.8°59.9°
O8C7OGCB11.3°0.0°
C7C9N10H10121.5°117.4°
C7C9N10C11129.9°87.4°
C7C9N10H1150.1°92.6°
C9C7OGCB169.1°179.5°
OGC7C9N10178.3°3.7°
OGC7C9H1058.8°120.6°
C7OGCBCA87.7°180.0°
C7OGCBHB2147.0°57.0°
C7OGCBHB337.5°59.0°
C9N10C11H11180.0°179.9°
C9N10C11O120.4°0.1°
C9N10C11C13178.3°179.8°
H10C9N10C118.3°30.0°
H10C9N10H11171.7°150.0°
N10C11O12C13178.6°179.8°
N10C11C13C1480.9°177.9°
N10C11C13H1244.3°60.0°
N10C11C13H13153.8°55.6°
H11N10C11O12179.6°180.0°
H11N10C11C131.8°0.2°
O12C11C13C1497.8°2.0°
O12C11C13H12136.9°120.2°
O12C11C13H1327.4°124.2°
C11C13C14H12125.2°121.7°
C11C13C14H13125.3°121.6°
C11C13H12H13118.9°116.9°
C11C13C14S15119.5°121.8°
C11C13C14C1860.2°58.2°
C14C13H12H13118.8°118.7°
C13C14S15C18179.7°180.0°
C13C14S15C16179.8°180.0°
C13C14C18C17179.7°180.0°
C13C14C18H160.3°0.1°
H12C13C14S155.8°0.0°
H12C13C14C18174.6°180.0°
H13C13C14S15115.3°116.7°
H13C13C14C1865.1°63.3°
C14S15C16C170.1°0.0°
C14S15C16H14180.0°179.9°
S15C14C18C170.0°0.0°
S15C14C18H16180.0°179.9°
C18C14S15C160.0°0.0°
C14C18C17C160.0°0.0°
C14C18C17H16180.0°179.9°
C14C18C17H15180.0°179.9°
S15C16C17H14180.0°179.9°
S15C16C17C180.1°0.0°
S15C16C17H15179.9°179.9°
C16C17C18H15180.0°179.9°
C16C17C18H16180.0°179.9°
H14C16C17C18179.9°179.9°
H14C16C17H150.1°0.0°
H15C17C18H160.0°0.2°
C22C23C24H4180.0°178.9°
C22C23C24C25177.4°91.2°
C22C23C24C293.1°88.9°
H5C22C23C247.4°0.3°
H5C22C23H4172.6°178.6°
C23C24C25C29179.5°179.9°
C23C24C25C26179.1°180.0°
C23C24C25N301.4°0.1°
C23C24C29C28179.3°180.0°
C23C24C29H30.7°0.1°
H4C23C24C252.6°89.9°
H4C23C24C29176.9°90.0°
C24C25C26N30179.6°180.0°
C24C25C26C270.4°0.1°
C24C25C26H1179.6°180.0°
C25C24C29C280.2°0.0°
C25C24C29H3179.8°180.0°
C24C25N30O310.3°180.0°
C24C25N30O32179.5°0.1°
C29C24C25C260.4°0.0°
C29C24C25N30179.1°180.0°
C24C29C28C270.0°0.1°
C24C29C28H3180.0°180.0°
C24C29C28HC28180.0°179.9°
C25C26C27H1180.0°180.0°
C25C26C27C280.1°0.1°
C25C26C27N33179.4°179.9°
C26C25N30O31179.3°0.0°
C26C25N30O320.1°180.0°
N30C25C26C27179.2°180.0°
N30C25C26H10.8°0.0°
C25N30O31O32179.2°179.9°
C26C27C28N33179.6°179.8°
C26C27C28C290.1°0.1°
C26C27C28HC28180.0°179.9°
C26C27N33O34179.4°179.9°
C26C27N33O350.2°0.1°
H1C26C27C28179.8°179.9°
H1C26C27N330.6°0.1°
C27C28C29HC28180.0°180.0°
C27C28C29H3180.0°180.0°
C28C27N33O340.1°0.1°
C28C27N33O35179.8°180.0°
N33C27C28C29179.6°179.9°
N33C27C28HC280.4°0.1°
C27N33O34O35179.7°179.9°
HC28C28C29H30.0°0.0°
CANHH2124.2°166.4°
NCACBC128.0°127.6°
NCACBH19115.6°114.6°
NCACH19115.0°114.2°
NCACBOG85.5°173.5°
NCACBHB2149.2°52.4°
NCACBHB339.7°67.4°
NCACO168.7°114.2°
NCACOXT16.5°64.9°
HNCACB54.7°117.3°
HNCAC179.0°112.7°
HNCAH1965.3°1.5°
H2NCACB180.0°49.4°
H2NCAC55.7°80.6°
H2NCAH1959.9°165.2°
CBCACH19120.2°118.8°
CACBOGHB2125.3°123.0°
CACBOGHB3125.2°121.0°
CACBHB2HB3117.4°121.3°
CBCACO66.5°118.8°
CBCACOXT141.3°62.0°
CCACBOG146.5°58.9°
CCACBHB221.2°180.0°
CCACBHB388.3°60.3°
CACOOXT152.5°179.0°
H19CACBOG30.1°58.9°
H19CACBHB295.1°62.2°
H19CACBHB3155.4°178.0°
H19CACO53.6°0.0°
H19CACOXT98.5°179.2°
OGCBHB2HB3117.4°115.8°

223790

PDB entries from 2024-08-14

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