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7NB

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
CAZCAYsing1.53Å1.53Å
CAYCAVsing1.51Å1.53Å
CAVNAUsing1.34Å1.33ÅAromatic
CAVCAWdoub1.36Å1.33ÅAromatic
NAUCARdoub1.33Å1.33ÅAromatic
CBNCBMdoub1.38Å1.39ÅAromatic
CBNCBHsing1.39Å1.39ÅAromatic
CBBNBAsing1.46Å1.47Å
CAWNBAsing1.40Å1.33Å
CAWNASsing1.37Å1.33ÅAromatic
CBMCBLsing1.39Å1.39ÅAromatic
NBACBCsing1.38Å1.33Å
CBCNBGdoub1.30Å1.34ÅAromatic
CBCSBDsing1.71Å1.71ÅAromatic
NBGCBFsing1.32Å1.34ÅAromatic
SBDCBEsing1.76Å1.71ÅAromatic
CBFCBHsing1.48Å1.33Å
CBFCBEdoub1.38Å1.34ÅAromatic
CBHCBJdoub1.40Å1.39ÅAromatic
CBECBIsing1.43Å1.43Å
CBLFBOsing1.35Å1.36Å
CBLCBKdoub1.39Å1.39ÅAromatic
CARNASsing1.37Å1.33ÅAromatic
CARCAQsing1.41Å1.33ÅAromatic
CBIN1trip1.14Å1.14Å
NASCATsing1.37Å1.40ÅAromatic
CBJCBKsing1.38Å1.39ÅAromatic
CAXCAQsing1.51Å1.39Å
CAQCAPdoub1.36Å1.39ÅAromatic
CATCAOdoub1.35Å1.39ÅAromatic
CAPCAOsing1.41Å1.39ÅAromatic
CAONALsing1.40Å1.34Å
NALCAKsing1.47Å1.48Å
NALCAMsing1.47Å1.48Å
CAKCAJsing1.53Å1.52Å
CAMCANsing1.53Å1.52Å
CAJNsing1.47Å1.47Å
CANNsing1.47Å1.47Å
NCAsing1.47Å1.47Å
CACsing1.51Å1.53Å
CAANADsing1.47Å1.48Å
CAACABsing1.53Å1.52Å
CNADsing1.35Å1.34Å
COdoub1.21Å1.23Å
NADCACsing1.47Å1.48Å
CABCACsing1.53Å1.52Å
CABOAEsing1.43Å1.44Å
CAAH1sing1.09Å1.10Å
CAAH2sing1.09Å1.10Å
CABH3sing1.09Å1.10Å
OAEH4sing0.97Å0.95Å
CACH5sing1.09Å1.10Å
CACH6sing1.09Å1.10Å
CAH7sing1.09Å1.10Å
CAH8sing1.09Å1.10Å
CANH10sing1.09Å1.10Å
CANH11sing1.09Å1.10Å
CAMH12sing1.09Å1.10Å
CAMH13sing1.09Å1.10Å
CAJH14sing1.09Å1.10Å
CAJH15sing1.09Å1.10Å
CAKH16sing1.09Å1.10Å
CAKH17sing1.09Å1.10Å
CATH18sing1.08Å1.08Å
CAPH19sing1.08Å1.08Å
CAXH20sing1.09Å1.10Å
CAXH21sing1.09Å1.10Å
CAXH22sing1.09Å1.10Å
CAYH23sing1.09Å1.10Å
CAYH24sing1.09Å1.10Å
CAZH25sing1.09Å1.10Å
CAZH26sing1.09Å1.10Å
CAZH27sing1.09Å1.10Å
CBBH28sing1.09Å1.10Å
CBBH29sing1.09Å1.10Å
CBBH30sing1.09Å1.10Å
CBJH31sing1.08Å1.08Å
CBKH32sing1.08Å1.08Å
CBMH33sing1.08Å1.08Å
CBNH34sing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
CAZCAYCAV109.7°109.5°
CAZCAYH23109.4°109.5°
CAZCAYH24109.4°109.5°
CAYCAZH25109.5°109.4°
CAYCAZH26109.5°109.5°
CAYCAZH27109.5°109.5°
CAYCAVNAU124.2°125.7°
CAYCAVCAW126.6°125.8°
CAVCAYH23109.4°109.4°
CAVCAYH24109.4°109.5°
NAUCAVCAW109.2°108.5°
CAVNAUCAR106.9°109.2°
CAVCAWNBA129.5°126.4°
CAVCAWNAS107.3°107.1°
NAUCARNAS108.6°108.1°
NAUCARCAQ132.4°132.2°
CBMCBNCBH120.2°119.9°
CBNCBMCBL120.1°120.1°
CBNCBMH33119.9°120.0°
CBMCBNH34119.9°120.1°
CBNCBHCBF121.3°120.1°
CBNCBHCBJ119.6°119.8°
CBHCBNH34119.9°120.0°
CBBNBACAW119.1°120.0°
CBBNBACBC120.0°120.0°
NBACBBH28109.5°109.5°
NBACBBH29109.5°109.5°
NBACBBH30109.4°109.5°
NBACAWNAS123.3°126.5°
CAWNBACBC120.8°120.0°
CAWNASCAR108.1°107.1°
CAWNASCAT128.0°132.5°
CBMCBLFBO120.1°119.9°
CBMCBLCBK119.8°120.2°
CBLCBMH33120.0°119.9°
NBACBCNBG125.3°124.5°
NBACBCSBD126.2°124.6°
NBGCBCSBD108.5°110.8°
CBCNBGCBF115.0°117.3°
CBCSBDCBE92.9°90.6°
NBGCBFCBH120.5°123.2°
NBGCBFCBE115.5°113.5°
SBDCBECBF108.1°107.7°
SBDCBECBI124.8°126.1°
CBHCBFCBE124.0°123.2°
CBFCBHCBJ119.2°120.1°
CBFCBECBI127.1°126.1°
CBHCBJCBK120.3°119.9°
CBHCBJH31119.9°120.0°
CBECBIN1179.9°180.0°
FBOCBLCBK120.1°119.9°
CBLCBKCBJ120.1°120.1°
CBLCBKH32120.0°120.0°
NASCARCAQ119.0°119.7°
CARNASCAT123.9°120.4°
CARCAQCAX119.9°120.3°
CARCAQCAP120.8°119.5°
NASCATCAO117.7°120.5°
NASCATH18121.1°119.8°
CBKCBJH31119.9°120.0°
CBJCBKH32119.9°119.9°
CAXCAQCAP119.3°120.2°
CAQCAXH20109.5°109.4°
CAQCAXH21109.5°109.5°
CAQCAXH22109.5°109.5°
CAQCAPCAO120.9°119.7°
CAQCAPH19119.6°120.2°
CATCAOCAP117.8°120.2°
CATCAONAL121.0°119.9°
CAOCATH18121.2°119.8°
CAPCAONAL121.2°119.9°
CAOCAPH19119.6°120.1°
CAONALCAK119.2°120.9°
CAONALCAM119.3°120.8°
CAKNALCAM120.8°118.2°
NALCAKCAJ113.7°108.5°
NALCAKH16108.4°109.7°
NALCAKH17108.4°109.8°
NALCAMCAN111.4°108.5°
NALCAMH12109.0°109.6°
NALCAMH13109.0°109.8°
CAKCAJN111.5°109.4°
CAKCAJH14109.0°109.5°
CAKCAJH15109.0°109.5°
CAJCAKH16108.4°109.6°
CAJCAKH17108.4°109.6°
CAMCANN109.3°109.3°
CAMCANH10109.5°109.5°
CAMCANH11109.5°109.5°
CANCAMH12109.0°109.6°
CANCAMH13109.0°109.6°
CAJNCAN107.7°111.2°
CAJNCA110.1°111.0°
NCAJH14109.0°109.5°
NCAJH15109.0°109.5°
CANNCA110.1°111.0°
NCANH10109.5°109.5°
NCANH11109.5°109.5°
NCAC109.4°109.5°
NCAH7109.5°109.5°
NCAH8109.5°109.5°
CACNAD115.7°120.0°
CACO120.6°120.0°
CCAH7109.5°109.4°
CCAH8109.5°109.4°
NADCAACAB90.4°88.0°
CAANADC135.0°136.1°
CAANADCAC90.7°87.8°
NADCAAH1114.0°113.5°
NADCAAH2114.0°113.5°
CAACABCAC88.1°83.3°
CAACABOAE112.7°114.3°
CABCAAH1114.0°113.5°
CABCAAH2114.0°113.4°
CAACABH3113.0°114.2°
NADCO123.8°120.0°
CNADCAC134.3°136.1°
NADCACCAB90.5°88.0°
NADCACH5114.0°113.5°
NADCACH6114.0°113.5°
CACCABOAE112.9°114.2°
CACCABH3113.0°114.2°
CABCACH5114.0°113.5°
CABCACH6114.0°113.5°
OAECABH3114.4°113.4°
CABOAEH4109.5°114.1°
H1CAAH2109.4°112.8°
H5CACH6109.5°112.7°
H7CAH8109.5°109.4°
H10CANH11109.5°109.5°
H12CAMH13109.5°109.7°
H14CAJH15109.5°109.5°
H16CAKH17109.4°109.6°
H20CAXH21109.5°109.5°
H20CAXH22109.4°109.5°
H21CAXH22109.5°109.5°
H23CAYH24109.5°109.5°
H25CAZH26109.5°109.5°
H25CAZH27109.5°109.5°
H26CAZH27109.5°109.5°
H28CBBH29109.5°109.4°
H28CBBH30109.4°109.5°
H29CBBH30109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
CAZCAYCAVH23120.0°120.0°
CAZCAYCAVH24120.1°120.0°
CAZCAYCAVNAU82.8°94.7°
CAZCAYCAVCAW97.6°85.2°
CAZCAYH23H24119.9°120.0°
CAYCAZH25H26120.0°120.0°
CAYCAZH25H27120.0°120.0°
CAYCAZH26H27120.0°120.0°
CAYCAVNAUCAW179.7°179.9°
CAYCAVNAUCAR179.8°180.0°
CAYCAVCAWNBA0.5°0.1°
CAYCAVCAWNAS179.8°180.0°
CAVCAYH23H24119.9°120.0°
CAVCAYCAZH25180.0°180.0°
CAVCAYCAZH2660.0°60.0°
CAVCAYCAZH2760.0°60.0°
NAUCAVCAWNBA179.9°180.0°
NAUCAVCAWNAS0.2°0.1°
CAVNAUCARNAS0.0°0.0°
CAVNAUCARCAQ179.9°179.7°
NAUCAVCAYH23157.2°145.3°
NAUCAVCAYH2437.3°25.3°
CAWCAVNAUCAR0.1°0.0°
CAVCAWNBACBB105.3°95.1°
CAVCAWNBANAS179.7°179.9°
CAVCAWNBACBC77.9°85.0°
CAVCAWNASCAR0.1°0.1°
CAVCAWNASCAT179.9°180.0°
CAWCAVCAYH2322.4°34.8°
CAWCAVCAYH24142.3°154.7°
NAUCARNASCAW0.0°0.1°
NAUCARNASCAQ180.0°179.7°
NAUCARNASCAT180.0°180.0°
NAUCARCAQCAX0.0°0.1°
NAUCARCAQCAP180.0°179.9°
CBMCBNCBHH34180.0°179.5°
CBNCBMCBLH33180.0°179.8°
CBMCBNCBHCBF179.9°179.8°
CBMCBNCBHCBJ0.1°0.5°
CBNCBMCBLFBO180.0°179.7°
CBNCBMCBLCBK0.0°0.2°
CBHCBNCBMCBL0.1°0.5°
CBNCBHCBFNBG144.5°144.7°
CBNCBHCBFCBJ179.8°179.7°
CBNCBHCBFCBE35.5°35.1°
CBNCBHCBJCBK0.1°0.2°
CBNCBHCBJH31179.9°179.8°
CBHCBNCBMH33179.9°179.7°
CBBNBACAWCBC176.8°180.0°
CBBNBACAWNAS74.4°85.0°
CBBNBACBCNBG3.5°5.1°
CBBNBACBCSBD176.5°174.6°
NBACBBH28H29120.0°120.0°
NBACBBH28H30120.0°120.0°
NBACBBH29H30120.0°120.0°
CAWNBACBCNBG179.7°174.9°
CAWNBACBCSBD0.3°5.4°
NBACAWNASCAR179.9°180.0°
NBACAWNASCAT0.2°0.1°
CAWNBACBBH28180.0°95.1°
CAWNBACBBH2960.0°144.9°
CAWNBACBBH3060.0°24.9°
NASCAWNBACBC102.4°95.0°
CAWNASCARCAT179.9°179.9°
CAWNASCARCAQ180.0°179.8°
CAWNASCATCAO180.0°180.0°
CAWNASCATH180.0°0.1°
CBMCBLFBOCBK180.0°179.9°
CBMCBLCBKCBJ0.0°0.1°
CBMCBLCBKH32180.0°180.0°
CBLCBMCBNH34179.9°180.0°
NBACBCNBGSBD180.0°179.7°
NBACBCNBGCBF180.0°180.0°
NBACBCSBDCBE180.0°180.0°
CBCNBACBBH283.2°84.9°
CBCNBACBBH29116.8°35.1°
CBCNBACBBH30123.2°155.1°
NBGCBCSBDCBE0.0°0.3°
CBCNBGCBFCBH180.0°180.0°
CBCNBGCBFCBE0.0°0.1°
SBDCBCNBGCBF0.0°0.3°
CBCSBDCBECBF0.0°0.2°
CBCSBDCBECBI180.0°180.0°
NBGCBFCBESBD0.0°0.1°
NBGCBFCBHCBE180.0°179.9°
NBGCBFCBHCBJ35.3°35.0°
NBGCBFCBECBI180.0°179.9°
SBDCBECBFCBH180.0°179.8°
SBDCBECBFCBI180.0°179.8°
SBDCBECBIN152.0°0.2°
CBHCBFCBECBI0.0°0.0°
CBFCBHCBJCBK179.9°180.0°
CBFCBHCBJH310.1°0.1°
CBFCBHCBNH340.1°0.2°
CBECBFCBHCBJ144.7°145.2°
CBFCBECBIN1128.1°180.0°
CBHCBJCBKCBL0.0°0.1°
CBHCBJCBKH31180.0°180.0°
CBHCBJCBKH32180.0°180.0°
CBJCBHCBNH34179.9°179.9°
FBOCBLCBKCBJ180.0°180.0°
FBOCBLCBKH320.0°0.1°
FBOCBLCBMH330.1°0.0°
CBLCBKCBJH32180.0°179.9°
CBLCBKCBJH31180.0°179.9°
CBKCBLCBMH33179.9°180.0°
NASCARCAQCAX180.0°179.7°
NASCARCAQCAP0.0°0.3°
CARNASCATCAO0.1°0.1°
CARNASCATH18179.9°180.0°
CAQCARNASCAT0.0°0.3°
CARCAQCAXCAP179.9°180.0°
CARCAQCAPCAO0.0°0.0°
CARCAQCAPH19180.0°180.0°
CARCAQCAXH2090.0°180.0°
CARCAQCAXH21150.1°60.0°
CARCAQCAXH2230.0°60.1°
NASCATCAOH18180.0°180.0°
NASCATCAOCAP0.1°0.2°
NASCATCAONAL179.8°180.0°
CAXCAQCAPCAO179.9°180.0°
CAXCAQCAPH190.0°0.0°
CAQCAXH20H21120.0°120.0°
CAQCAXH20H22120.0°120.0°
CAQCAXH21H22120.0°120.0°
CAQCAPCAOCAT0.1°0.3°
CAQCAPCAOH19180.0°180.0°
CAQCAPCAONAL179.8°180.0°
CAPCAQCAXH2090.0°0.0°
CAPCAQCAXH2130.0°120.0°
CAPCAQCAXH22150.1°120.0°
CATCAOCAPNAL179.7°179.8°
CATCAONALCAK8.9°6.6°
CATCAONALCAM161.5°173.4°
CATCAOCAPH19180.0°179.8°
CAPCAONALCAK171.3°173.2°
CAPCAONALCAM18.2°6.8°
CAPCAOCATH18179.9°179.8°
CAONALCAKCAM170.3°180.0°
CAONALCAKCAJ164.6°128.8°
CAONALCAMCAN159.0°128.8°
CAONALCAMH1280.7°9.1°
CAONALCAMH1338.7°111.4°
CAONALCAKH1644.0°111.5°
CAONALCAKH1774.7°9.0°
NALCAOCATH180.2°0.0°
NALCAOCAPH190.2°0.0°
NALCAKCAJH16120.6°119.7°
NALCAKCAJH17120.6°119.9°
CAKNALCAMCAN30.7°51.2°
NALCAKCAJN40.6°53.9°
CAKNALCAMH1289.6°170.9°
CAKNALCAMH13151.0°68.5°
NALCAKCAJH1479.7°173.8°
NALCAKCAJH15160.9°66.1°
NALCAKH16H17118.1°120.6°
CAMNALCAKCAJ25.0°51.2°
NALCAMCANH12120.3°119.7°
NALCAMCANH13120.3°119.9°
NALCAMCANN52.1°53.9°
NALCAMCANH10172.1°66.1°
NALCAMCANH1167.8°173.8°
NALCAMH12H13119.2°120.6°
CAMNALCAKH16145.7°68.5°
CAMNALCAKH1795.6°171.0°
CAKCAJNH14120.3°119.9°
CAKCAJNH15120.3°120.0°
CAKCAJNCAN64.1°63.1°
CAKCAJNCA175.9°172.8°
CAKCAJH14H15119.1°120.1°
CAJCAKH16H17118.1°120.3°
CAMCANNCAJ70.3°63.1°
CAMCANNH10120.0°120.0°
CAMCANNH11120.0°119.9°
CAMCANNCA169.7°172.7°
CAMCANH10H11120.1°120.0°
CANCAMH12H13119.1°120.4°
CAJNCANCA120.0°124.1°
CAJNCAC88.0°65.7°
CAJNCAH7152.0°54.3°
CAJNCAH832.0°174.3°
CAJNCANH10169.7°56.8°
CAJNCANH1149.7°177.0°
NCAJH14H15119.1°120.1°
NCAJCAKH16161.2°65.9°
NCAJCAKH1780.1°173.7°
CANNCAC153.4°170.0°
CANNCAH733.4°70.0°
CANNCAH886.6°50.0°
NCANH10H11120.1°120.1°
NCANCAMH1268.1°173.5°
NCANCAMH13172.5°66.0°
CANNCAJH1456.2°176.9°
CANNCAJH15175.6°56.9°
NCACH7120.0°120.1°
NCACH8120.0°120.0°
NCACNAD115.7°180.0°
NCACO64.2°0.0°
NCAH7H8120.0°120.1°
CANCANH1049.7°67.3°
CANCANH1170.3°52.8°
CANCAJH1463.8°52.8°
CANCAJH1555.6°67.3°
CACNADCAA0.2°180.0°
CACNADO179.9°179.9°
CACNADCAC180.0°0.1°
CCAH7H8120.0°119.9°
NADCAACABH1116.6°114.8°
NADCAACABH2116.7°114.8°
CAANADCCAC179.9°179.9°
CAANADCO179.9°0.1°
NADCAACABCAC4.4°26.1°
NADCAACABOAE109.7°87.5°
NADCAAH1H2129.1°130.8°
NADCAACABH3118.7°139.6°
CAANADCACH5112.2°141.9°
CAANADCACH6121.1°87.7°
CABCAANADC175.4°152.8°
CAACABCACOAE113.9°113.6°
CAACABCACH3114.3°113.6°
CAACABOAEH3130.9°133.3°
CABCAAH1H2129.0°130.8°
CAACABOAEH4180.0°180.0°
CAACABCACH5112.3°140.9°
CAACABCACH6121.0°88.8°
CNADCACCAB175.4°152.8°
CNADCAAH158.8°92.4°
CNADCAAH267.9°38.1°
CNADCACH567.9°38.0°
CNADCACH658.8°92.3°
NADCCAH7124.3°60.0°
NADCCAH84.3°59.9°
OCNADCAC0.1°180.0°
OCCAH755.8°120.1°
OCCAH8175.8°120.0°
NADCACCABH5116.7°114.8°
NADCACCABH6116.7°114.8°
NADCACCABOAE109.5°87.6°
CACNADCAAH1121.1°87.7°
CACNADCAAH2112.2°141.9°
NADCACCABH3118.6°139.7°
NADCACH5H6129.0°130.8°
CACCABOAEH3131.1°133.1°
CACCABCAAH1121.0°88.7°
CACCABCAAH2112.3°140.9°
CACCABOAEH482.1°86.4°
CABCACH5H6129.0°130.8°
OAECABCAAH16.9°157.7°
OAECABCAAH2133.6°27.3°
OAECABCACH5133.8°27.2°
OAECABCACH67.1°157.6°
H1CAACABH3124.7°24.8°
H2CAACABH32.0°105.6°
H3CABOAEH449.1°46.7°
H3CABCACH52.0°105.5°
H3CABCACH6124.7°24.8°
H10CANCAMH1251.9°53.6°
H10CANCAMH1367.6°174.0°
H11CANCAMH12171.9°66.5°
H11CANCAMH1352.5°53.9°
H14CAJCAKH1640.9°54.1°
H14CAJCAKH17159.6°66.3°
H15CAJCAKH1678.5°174.1°
H15CAJCAKH1740.2°53.7°
H20CAXH21H22120.0°120.0°
H23CAYCAZH2560.0°60.0°
H23CAYCAZH2660.0°180.0°
H23CAYCAZH27180.0°60.0°
H24CAYCAZH2560.0°60.0°
H24CAYCAZH26179.9°60.0°
H24CAYCAZH2760.1°180.0°
H25CAZH26H27120.0°120.0°
H28CBBH29H30120.0°120.0°
H31CBJCBKH320.0°0.0°
H33CBMCBNH340.1°0.2°

222624

PDB entries from 2024-07-17

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