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8B8

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
NBOCBLsing1.48Å1.32Å
CBKCBLdoub1.38Å1.38ÅAromatic
CBKCBJsing1.38Å1.39ÅAromatic
CBLCBMsing1.38Å1.38ÅAromatic
CBJCBIdoub1.39Å1.39ÅAromatic
NAFCAEsing1.37Å1.32ÅAromatic
NAFCAGsing1.38Å1.33ÅAromatic
CBMCBNdoub1.38Å1.38ÅAromatic
CAECADdoub1.34Å1.32ÅAromatic
CBICBNsing1.39Å1.39ÅAromatic
CBINBHsing1.40Å1.33Å
CAHCAGdoub1.39Å1.33ÅAromatic
CAHCAIsing1.38Å1.38ÅAromatic
CAGCALsing1.41Å1.34ÅAromatic
NBHCBFsing1.35Å1.34Å
CAICAJdoub1.39Å1.38ÅAromatic
OBGCBFdoub1.22Å1.23Å
CADCALsing1.46Å1.33ÅAromatic
CADCACsing1.51Å1.55Å
CALCAKdoub1.40Å1.33ÅAromatic
CBFNBEsing1.35Å1.35Å
CACCABsing1.53Å1.54Å
CAJCAKsing1.37Å1.39ÅAromatic
NBECABsing1.46Å1.47Å
CABCAMsing1.51Å1.53Å
CABCAAsing1.53Å1.52Å
CAMOANdoub1.21Å1.23Å
CAMNAOsing1.35Å1.33Å
NAOCAPsing1.47Å1.48Å
CAPCAQsing1.53Å1.54Å
CAQCAWsing1.51Å1.38Å
CAQCARsing1.53Å1.51Å
CAQCAVsing1.53Å1.51Å
CAWNAXdoub1.32Å1.34ÅAromatic
CAWCBBsing1.38Å1.39ÅAromatic
NAXCAYsing1.32Å1.39ÅAromatic
CARCASsing1.53Å1.51Å
CAUCAVsing1.53Å1.51Å
CAUCATsing1.53Å1.51Å
CBBCBAdoub1.39Å1.38ÅAromatic
CAYCAZdoub1.39Å1.38ÅAromatic
CBACAZsing1.39Å1.38ÅAromatic
CAZOBCsing1.36Å1.36Å
OBCCBDsing1.43Å1.43Å
CATCASsing1.53Å1.51Å
CBDH1sing1.09Å1.10Å
CBDH2sing1.09Å1.10Å
CBDH3sing1.09Å1.10Å
CAYH4sing1.08Å1.08Å
CBAH5sing1.08Å1.08Å
CBBH6sing1.08Å1.08Å
CARH7sing1.09Å1.10Å
CARH8sing1.09Å1.10Å
CASH9sing1.09Å1.10Å
CASH10sing1.09Å1.10Å
CATH11sing1.09Å1.10Å
CATH12sing1.09Å1.10Å
CAUH13sing1.09Å1.10Å
CAUH14sing1.09Å1.10Å
CAVH15sing1.09Å1.10Å
CAVH16sing1.09Å1.10Å
CAPH17sing1.09Å1.10Å
CAPH18sing1.09Å1.10Å
NAOH19sing0.97Å1.00Å
NBEH20sing0.97Å1.00Å
NBHH21sing0.97Å1.00Å
CBJH22sing1.08Å1.08Å
CBKH23sing1.08Å1.08Å
CBMH26sing1.08Å1.08Å
CBNH27sing1.08Å1.08Å
CAAH28sing1.09Å1.10Å
CAAH29sing1.09Å1.10Å
CAAH30sing1.09Å1.10Å
CACH31sing1.09Å1.10Å
CACH32sing1.09Å1.10Å
CAKH33sing1.08Å1.08Å
CAJH34sing1.08Å1.08Å
CAIH35sing1.08Å1.08Å
CAHH36sing1.08Å1.08Å
NAFH37sing0.97Å1.00Å
CAEH38sing1.08Å1.08Å
NBOO1sing1.22Å28.89Å
NBOO2doub1.22Å28.89Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
NBOCBLCBK120.4°119.9°
NBOCBLCBM119.6°119.9°
CBLNBOO149.9°120.0°
CBLNBOO249.9°120.0°
CBLCBKCBJ120.7°120.1°
CBKCBLCBM120.0°120.2°
CBLCBKH23119.7°120.0°
CBKCBJCBI119.5°119.9°
CBKCBJH22120.2°120.0°
CBJCBKH23119.7°120.0°
CBLCBMCBN119.4°120.0°
CBLCBMH26120.3°120.0°
CBJCBICBN119.4°119.9°
CBJCBINBH125.8°120.1°
CBICBJH22120.3°120.0°
CAENAFCAG108.1°109.9°
NAFCAECAD108.0°109.9°
CAENAFH37125.9°125.1°
NAFCAEH38126.0°125.1°
NAFCAGCAH130.4°133.5°
NAFCAGCAL108.2°107.1°
CAGNAFH37125.9°125.1°
CBMCBNCBI121.1°119.9°
CBNCBMH26120.3°120.0°
CBMCBNH27119.5°120.0°
CAECADCAL108.4°107.0°
CAECADCAC124.4°126.5°
CADCAEH38126.0°125.0°
CBNCBINBH114.8°120.1°
CBICBNH27119.5°120.0°
CBINBHCBF124.8°120.0°
CBINBHH21117.6°120.0°
CAGCAHCAI120.7°119.8°
CAHCAGCAL121.4°119.4°
CAGCAHH36119.7°120.2°
CAHCAICAJ118.1°120.6°
CAHCAIH35121.0°119.7°
CAICAHH36119.7°120.1°
CAGCALCAD107.2°106.1°
CAGCALCAK120.5°119.9°
NBHCBFOBG123.6°120.0°
NBHCBFNBE113.0°119.9°
CBFNBHH21117.6°120.0°
CAICAJCAK118.8°120.6°
CAICAJH34120.6°119.8°
CAJCAIH35121.0°119.7°
OBGCBFNBE123.4°120.0°
CALCADCAC127.1°126.5°
CADCALCAK132.3°134.0°
CADCACCAB111.8°109.4°
CADCACH31108.9°109.5°
CADCACH32108.9°109.5°
CALCAKCAJ120.5°119.7°
CALCAKH33119.8°120.1°
CBFNBECAB124.6°119.9°
CBFNBEH20117.7°120.0°
CACCABNBE111.8°109.5°
CACCABCAM114.5°109.5°
CACCABCAA108.4°109.5°
CABCACH31108.9°109.5°
CABCACH32108.9°109.4°
CAJCAKH33119.7°120.2°
CAKCAJH34120.6°119.7°
NBECABCAM107.2°109.4°
NBECABCAA107.6°109.5°
CABNBEH20117.7°120.0°
CAMCABCAA107.0°109.5°
CABCAMOAN119.9°120.0°
CABCAMNAO118.7°120.0°
CABCAAH28109.5°109.5°
CABCAAH29109.4°109.5°
CABCAAH30109.5°109.5°
OANCAMNAO121.3°120.0°
CAMNAOCAP118.4°120.0°
CAMNAOH19120.8°119.9°
NAOCAPCAQ115.8°109.4°
NAOCAPH17107.9°109.5°
NAOCAPH18107.9°109.4°
CAPNAOH19120.8°120.0°
CAPCAQCAW111.2°109.4°
CAPCAQCAR107.6°109.4°
CAPCAQCAV111.7°109.5°
CAQCAPH17107.9°109.5°
CAQCAPH18107.8°109.5°
CAWCAQCAR110.2°109.5°
CAWCAQCAV107.9°109.5°
CAQCAWNAX119.7°119.6°
CAQCAWCBB119.6°119.6°
CARCAQCAV108.1°109.5°
CAQCARCAS109.8°109.5°
CAQCARH7109.4°109.5°
CAQCARH8109.4°109.5°
CAQCAVCAU109.5°109.5°
CAQCAVH15109.5°109.5°
CAQCAVH16109.4°109.5°
NAXCAWCBB120.7°120.9°
CAWNAXCAY120.3°121.8°
CAWCBBCBA120.0°119.2°
CAWCBBH6120.0°120.4°
NAXCAYCAZ119.8°120.7°
NAXCAYH4120.1°119.6°
CARCASCAT109.7°109.4°
CASCARH7109.4°109.5°
CASCARH8109.4°109.4°
CARCASH9109.4°109.5°
CARCASH10109.4°109.5°
CAVCAUCAT108.7°109.5°
CAVCAUH13109.6°109.5°
CAVCAUH14109.7°109.4°
CAUCAVH15109.5°109.5°
CAUCAVH16109.5°109.4°
CAUCATCAS109.3°109.5°
CAUCATH11109.5°109.5°
CAUCATH12109.5°109.5°
CATCAUH13109.7°109.5°
CATCAUH14109.7°109.5°
CBBCBACAZ119.2°118.3°
CBBCBAH5120.4°120.8°
CBACBBH6120.0°120.3°
CAYCAZCBA119.9°119.1°
CAYCAZOBC119.8°120.5°
CAZCAYH4120.1°119.7°
CBACAZOBC120.3°120.4°
CAZCBAH5120.4°120.9°
CAZOBCCBD109.2°117.0°
OBCCBDH1109.5°109.5°
OBCCBDH2109.5°109.5°
OBCCBDH3109.5°109.5°
CATCASH9109.4°109.5°
CATCASH10109.4°109.4°
CASCATH11109.5°109.5°
CASCATH12109.5°109.5°
H1CBDH2109.4°109.5°
H1CBDH3109.5°109.4°
H2CBDH3109.5°109.5°
H7CARH8109.5°109.5°
H9CASH10109.5°109.5°
H11CATH12109.4°109.5°
H13CAUH14109.4°109.5°
H15CAVH16109.5°109.5°
H17CAPH18109.4°109.5°
H28CAAH29109.5°109.4°
H28CAAH30109.4°109.5°
H29CAAH30109.5°109.4°
H31CACH32109.5°109.5°
O1NBOO2NaN°120.0°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
NBOCBLCBKCBM179.8°179.9°
NBOCBLCBKCBJ179.7°179.9°
NBOCBLCBMCBN179.6°180.0°
NBOCBLCBKH230.3°0.1°
NBOCBLCBMH260.4°0.1°
CBLNBOO1O290.0°179.9°
CBLCBKCBJH23180.0°179.9°
CBLCBKCBJCBI0.3°0.0°
CBKCBLCBMCBN0.2°0.1°
CBLCBKCBJH22179.7°179.9°
CBKCBLCBMH26179.8°180.0°
CBKCBLNBOO1152.4°0.1°
CBKCBLNBOO2152.4°180.0°
CBJCBKCBLCBM0.1°0.0°
CBKCBJCBIH22180.0°179.9°
CBKCBJCBICBN0.6°0.0°
CBKCBJCBINBH180.0°179.8°
CBLCBMCBNH26180.0°180.0°
CBLCBMCBNCBI0.5°0.0°
CBMCBLCBKH23179.9°180.0°
CBLCBMCBNH27179.5°179.8°
CBMCBLNBOO127.3°180.0°
CBMCBLNBOO227.3°0.1°
CBJCBICBNCBM0.7°0.0°
CBJCBICBNNBH179.4°179.8°
CBJCBINBHCBF41.8°34.4°
CBJCBINBHH21138.2°145.5°
CBICBJCBKH23179.7°179.9°
CBJCBICBNH27179.3°179.7°
CAENAFCAGH37180.0°179.6°
NAFCAECADH38180.0°179.6°
CAENAFCAGCAH179.6°179.8°
CAENAFCAGCAL0.3°0.2°
NAFCAECADCAL1.8°0.4°
NAFCAECADCAC179.0°179.9°
CAGNAFCAECAD1.3°0.4°
NAFCAGCAHCAL179.9°180.0°
NAFCAGCAHCAI179.9°179.9°
NAFCAGCALCAD0.8°0.0°
NAFCAGCALCAK179.9°180.0°
NAFCAGCAHH360.0°0.0°
CAGNAFCAEH38178.7°180.0°
CBMCBNCBIH27180.0°179.7°
CBMCBNCBINBH179.9°179.7°
CAECADCALCAG1.6°0.2°
CAECADCALCAC177.1°179.7°
CAECADCALCAK179.5°179.7°
CAECADCACCAB72.5°91.9°
CAECADCACH31167.2°148.1°
CAECADCACH3247.9°28.0°
CADCAENAFH37178.7°180.0°
CBNCBINBHCBF138.8°145.8°
CBNCBINBHH2141.2°34.3°
CBNCBICBJH22179.4°179.9°
CBICBNCBMH26179.5°180.0°
CBINBHCBFH21180.0°179.9°
CBINBHCBFOBG4.1°5.2°
CBINBHCBFNBE175.5°174.8°
NBHCBICBJH220.0°0.3°
NBHCBICBNH270.1°0.0°
CAGCAHCAIH36180.0°179.9°
CAGCAHCAICAJ0.0°0.1°
CAHCAGCALCAD179.3°180.0°
CAHCAGCALCAK0.2°0.0°
CAGCAHCAIH35180.0°180.0°
CAHCAGNAFH370.4°0.2°
CAICAHCAGCAL0.2°0.1°
CAHCAICAJH35180.0°179.9°
CAHCAICAJCAK0.1°0.0°
CAHCAICAJH34179.9°180.0°
CAGCALCADCAK178.9°180.0°
CAGCALCADCAC178.7°180.0°
CAGCALCAKCAJ0.1°0.0°
CAGCALCAKH33179.9°180.0°
CALCAGCAHH36179.9°180.0°
CALCAGNAFH37179.7°179.8°
NBHCBFOBGNBE179.6°180.0°
NBHCBFNBECAB179.0°180.0°
NBHCBFNBEH201.0°0.0°
CAICAJCAKCAL0.1°0.0°
CAICAJCAKH34180.0°180.0°
CAICAJCAKH33179.9°180.0°
CAJCAICAHH36180.0°180.0°
OBGCBFNBECAB0.7°0.0°
OBGCBFNBEH20179.3°180.0°
OBGCBFNBHH21175.9°174.9°
CALCADCACCAB110.8°88.4°
CADCALCAKCAJ178.9°180.0°
CALCADCACH319.5°31.6°
CALCADCACH32128.8°151.7°
CADCALCAKH331.1°0.1°
CALCADCAEH38178.2°180.0°
CACCADCALCAK2.3°0.0°
CADCACCABH31120.3°120.0°
CADCACCABH32120.4°120.0°
CADCACCABNBE57.9°62.3°
CADCACCABCAM180.0°57.7°
CADCACCABCAA60.6°177.7°
CADCACH31H32119.0°120.0°
CACCADCAEH381.0°0.2°
CALCAKCAJH33180.0°179.9°
CALCAKCAJH34179.9°180.0°
CBFNBECABCAC68.9°60.0°
CBFNBECABH20180.0°180.0°
CBFNBECABCAM57.3°180.0°
CBFNBECABCAA172.2°60.0°
NBECBFNBHH214.5°5.1°
CACCABNBECAM126.2°120.0°
CACCABNBECAA119.0°120.0°
CACCABCAMCAA120.2°120.0°
CACCABCAMOAN145.1°92.8°
CACCABCAMNAO37.3°87.3°
CACCABNBEH20111.1°120.0°
CACCABCAAH28180.0°180.0°
CACCABCAAH2960.0°60.0°
CACCABCAAH3060.0°59.9°
CABCACH31H32118.9°120.0°
CAKCAJCAIH35179.9°179.9°
NBECABCAMCAA115.2°120.0°
NBECABCAMOAN20.5°147.2°
NBECABCAMNAO161.9°32.8°
NBECABCAAH2858.9°59.9°
NBECABCAAH2961.1°60.0°
NBECABCAAH30178.9°180.0°
NBECABCACH31178.3°177.7°
NBECABCACH3262.4°57.7°
CABCAMOANNAO177.6°180.0°
CABCAMNAOCAP178.1°175.3°
CABCAMNAOH192.0°4.7°
CAMCABNBEH20122.7°0.0°
CAMCABCAAH2856.0°60.0°
CAMCABCAAH29176.0°180.0°
CAMCABCAAH3064.0°60.0°
CAMCABCACH3159.6°62.3°
CAMCABCACH3259.7°177.7°
CAACABCAMOAN94.8°27.2°
CAACABCAMNAO82.9°152.8°
CAACABNBEH207.8°120.0°
CABCAAH28H29120.0°120.0°
CABCAAH28H30120.0°120.1°
CABCAAH29H30120.0°120.0°
CAACABCACH3159.8°57.7°
CAACABCACH32179.1°62.3°
OANCAMNAOCAP4.3°4.7°
OANCAMNAOH19175.6°175.3°
CAMNAOCAPH19180.0°180.0°
CAMNAOCAPCAQ99.0°91.6°
CAMNAOCAPH17140.1°148.4°
CAMNAOCAPH1821.9°28.4°
NAOCAPCAQH17120.9°120.0°
NAOCAPCAQH18120.9°119.9°
NAOCAPCAQCAW50.1°65.3°
NAOCAPCAQCAR171.0°174.7°
NAOCAPCAQCAV70.5°54.7°
NAOCAPH17H18117.1°120.0°
CAPCAQCAWCAR119.3°119.9°
CAPCAQCAWCAV122.8°120.0°
CAPCAQCARCAV120.8°120.0°
CAPCAQCAWNAX84.8°103.3°
CAPCAQCAWCBB96.7°76.6°
CAPCAQCARCAS143.0°60.0°
CAPCAQCAVCAU73.8°60.0°
CAPCAQCARH796.9°180.0°
CAPCAQCARH823.0°60.0°
CAPCAQCAVH1546.2°60.0°
CAPCAQCAVH16166.2°180.0°
CAQCAPH17H18117.1°120.0°
CAQCAPNAOH1981.0°88.4°
CAWCAQCARCAV117.8°120.0°
CAQCAWNAXCBB178.5°179.8°
CAQCAWNAXCAY179.8°180.0°
CAWCAQCARCAS95.5°180.0°
CAWCAQCAVCAU163.7°180.0°
CAQCAWCBBCBA179.8°180.0°
CAQCAWCBBH60.2°0.1°
CAWCAQCARH724.5°60.1°
CAWCAQCARH8144.4°60.0°
CAWCAQCAVH1576.3°60.0°
CAWCAQCAVH1643.7°60.0°
CAWCAQCAPH1770.8°174.7°
CAWCAQCAPH18171.1°54.6°
CARCAQCAWNAX34.4°16.7°
CARCAQCAWCBB144.1°163.5°
CAQCARCASH7120.0°120.0°
CAQCARCASH8120.1°120.0°
CARCAQCAVCAU44.4°60.0°
CAQCARCASCAT69.3°60.0°
CAQCARH7H8119.8°120.1°
CAQCARCASH950.8°180.0°
CAQCARCASH10170.7°59.9°
CARCAQCAVH15164.4°180.0°
CARCAQCAVH1675.6°60.0°
CARCAQCAPH1750.0°54.7°
CARCAQCAPH1868.1°65.3°
CAVCAQCAWNAX152.3°136.7°
CAVCAQCAWCBB26.2°43.4°
CAVCAQCARCAS22.3°60.0°
CAQCAVCAUH15120.0°120.1°
CAQCAVCAUH16120.0°120.0°
CAQCAVCAUCAT72.0°60.0°
CAVCAQCARH7142.3°60.0°
CAVCAQCARH897.8°180.0°
CAQCAVCAUH1347.9°180.0°
CAQCAVCAUH14168.1°60.0°
CAQCAVH15H16120.0°120.0°
CAVCAQCAPH17168.5°65.3°
CAVCAQCAPH1850.4°174.6°
NAXCAWCBBCBA1.3°0.2°
CAWNAXCAYCAZ0.8°0.1°
CAWNAXCAYH4179.2°180.0°
NAXCAWCBBH6178.7°179.8°
CBBCAWNAXCAY1.3°0.2°
CAWCBBCBAH6180.0°180.0°
CAWCBBCBACAZ0.7°0.1°
CAWCBBCBAH5179.3°179.9°
NAXCAYCAZH4180.0°179.9°
NAXCAYCAZCBA0.2°0.3°
NAXCAYCAZOBC179.9°180.0°
CARCASCATCAU41.8°60.0°
CARCASCATH9120.0°120.0°
CARCASCATH10120.0°120.0°
CASCARH7H8119.9°120.0°
CARCASH9H10119.9°120.1°
CARCASCATH1178.2°60.0°
CARCASCATH12161.8°180.0°
CAVCAUCATH13119.9°120.0°
CAVCAUCATH14119.9°120.0°
CAVCAUCATCAS24.4°60.0°
CAVCAUCATH11144.4°60.0°
CAVCAUCATH1295.6°180.0°
CAVCAUH13H14120.3°120.0°
CAUCAVH15H16120.0°119.9°
CAUCATCASH11120.0°120.0°
CAUCATCASH12120.0°120.0°
CAUCATCASH978.3°180.0°
CAUCATCASH10161.8°60.0°
CAUCATH11H12120.1°120.0°
CATCAUH13H14120.4°120.0°
CATCAUCAVH15168.0°180.0°
CATCAUCAVH1647.9°60.0°
CBBCBACAZCAY0.2°0.3°
CBBCBACAZH5180.0°180.0°
CBBCBACAZOBC179.9°180.0°
CAYCAZCBAOBC179.8°179.7°
CAYCAZOBCCBD6.0°0.0°
CAYCAZCBAH5179.8°179.7°
CBACAZOBCCBD174.2°179.7°
CBACAZCAYH4179.7°179.8°
CAZCBACBBH6179.3°180.0°
CAZOBCCBDH1180.0°60.0°
CAZOBCCBDH260.0°180.0°
CAZOBCCBDH360.0°60.0°
OBCCAZCAYH40.1°0.1°
OBCCAZCBAH50.1°0.0°
OBCCBDH1H2120.0°120.0°
OBCCBDH1H3120.0°120.0°
OBCCBDH2H3120.0°120.1°
CATCASCARH7170.7°60.0°
CATCASCARH850.8°180.0°
CATCASH9H10119.9°120.0°
CASCATH11H12120.1°120.0°
CASCATCAUH1395.5°180.0°
CASCATCAUH14144.3°60.0°
H1CBDH2H3120.0°119.9°
H5CBACBBH60.7°0.0°
H7CARCASH969.2°60.0°
H7CARCASH1050.7°179.9°
H8CARCASH9170.8°60.0°
H8CARCASH1069.2°60.1°
H9CASCATH11161.7°60.0°
H9CASCATH1241.7°60.0°
H10CASCATH1141.8°180.0°
H10CASCATH1278.2°60.0°
H11CATCAUH1324.5°60.0°
H11CATCAUH1495.7°180.0°
H12CATCAUH13144.6°60.0°
H12CATCAUH1424.3°60.0°
H13CAUCAVH1572.1°60.0°
H13CAUCAVH16167.8°60.0°
H14CAUCAVH1548.1°60.0°
H14CAUCAVH1672.0°180.0°
H17CAPNAOH1940.0°31.6°
H18CAPNAOH19158.1°151.7°
H22CBJCBKH230.3°0.0°
H26CBMCBNH270.5°0.3°
H28CAAH29H30120.0°119.9°
H33CAKCAJH340.1°0.0°
H34CAJCAIH350.1°0.1°
H35CAICAHH360.0°0.1°
H37NAFCAEH381.3°0.3°

223532

PDB entries from 2024-08-07

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