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981

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
CLAECADsing1.74Å1.78Å
CACCADdoub1.38Å1.36ÅAromatic
CACCABsing1.38Å1.37ÅAromatic
CLAACABsing1.74Å1.78Å
CADCALsing1.40Å1.40ÅAromatic
CABCAJdoub1.38Å1.38ÅAromatic
CALCAMsing1.48Å1.50Å
CALCAKdoub1.39Å1.37ÅAromatic
CANCAMdoub1.37Å1.42Å
CANCAOsing1.41Å1.46Å
CAPNAQdoub1.32Å1.36ÅAromatic
CAPCAOsing1.40Å1.37ÅAromatic
CAJCAKsing1.38Å1.38ÅAromatic
CAMCAXsing1.46Å1.53Å
NAQCBBsing1.33Å1.36ÅAromatic
CAOCAZdoub1.41Å1.39ÅAromatic
CBBNBAdoub1.32Å1.35ÅAromatic
CBBNBCsing1.38Å1.45Å
CAZNBAsing1.33Å1.32ÅAromatic
CAZNAYsing1.37Å1.43Å
CAXOBGdoub1.22Å1.39Å
CAXNAYsing1.35Å1.42Å
NBCCBDsing1.40Å1.46Å
NAYCBHsing1.46Å1.51Å
CBECBDdoub1.39Å1.40ÅAromatic
CBECBFsing1.38Å1.41ÅAromatic
CBDCARsing1.39Å1.38ÅAromatic
CBICBHsing1.53Å1.54Å
CBFCATdoub1.39Å1.37ÅAromatic
CARCASdoub1.38Å1.39ÅAromatic
CATCASsing1.39Å1.40ÅAromatic
CATNAUsing1.40Å1.47Å
CASFAFsing1.35Å1.35Å
CAVNAUsing1.47Å1.47Å
CAVCAWsing1.53Å1.53Å
NAUCAGsing1.47Å1.46Å
CAGCAHsing1.53Å1.54Å
CAWNAIsing1.47Å1.46Å
CAHNAIsing1.47Å1.46Å
CACH1sing1.08Å1.08Å
CAGH2sing1.09Å1.10Å
CAHH3sing1.09Å1.10Å
CAJH4sing1.08Å1.08Å
CAKH5sing1.08Å1.08Å
CANH6sing1.08Å1.08Å
CAPH7sing1.08Å1.08Å
CARH8sing1.08Å1.08Å
CAVH9sing1.09Å1.10Å
CAVH10sing1.09Å1.10Å
CAWH11sing1.09Å1.10Å
CAWH12sing1.09Å1.10Å
CBEH13sing1.08Å1.08Å
CBFH14sing1.08Å1.08Å
CBHH15sing1.09Å1.10Å
CBHH16sing1.09Å1.10Å
CBIH17sing1.09Å1.10Å
CBIH18sing1.09Å1.10Å
CBIH19sing1.09Å1.10Å
NAIH20sing1.01Å1.00Å
NBCH21sing0.97Å1.00Å
CAGH22sing1.09Å1.10Å
CAHH23sing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
CLAECADCAC113.6°120.1°
CLAECADCAL128.6°120.1°
CADCACCAB120.7°120.1°
CACCADCAL117.8°119.8°
CADCACH1119.6°119.9°
CACCABCLAA113.8°119.9°
CACCABCAJ120.8°120.3°
CABCACH1119.6°120.0°
CLAACABCAJ125.4°119.9°
CADCALCAM118.9°120.1°
CADCALCAK122.7°119.7°
CABCAJCAK120.0°120.1°
CABCAJH4120.0°119.9°
CAMCALCAK118.3°120.1°
CALCAMCAN119.1°120.3°
CALCAMCAX118.7°120.3°
CALCAKCAJ118.0°119.9°
CALCAKH5121.0°120.1°
CAMCANCAO114.7°119.0°
CANCAMCAX122.2°119.4°
CAMCANH6122.7°120.5°
CANCAOCAP116.3°121.2°
CANCAOCAZ123.3°120.2°
CAOCANH6122.6°120.4°
NAQCAPCAO120.1°118.6°
CAPNAQCBB119.3°121.2°
NAQCAPH7119.9°120.7°
CAPCAOCAZ120.4°118.6°
CAOCAPH7119.9°120.7°
CAKCAJH4120.0°120.0°
CAJCAKH5121.0°120.0°
CAMCAXOBG118.0°119.8°
CAMCAXNAY119.6°120.4°
NAQCBBNBA119.0°122.4°
NAQCBBNBC118.9°118.8°
CAOCAZNBA117.0°118.7°
CAOCAZNAY123.7°120.4°
NBACBBNBC122.0°118.8°
CBBNBACAZ124.1°120.5°
CBBNBCCBD126.0°120.0°
CBBNBCH21117.0°120.0°
NBACAZNAY119.3°120.9°
CAZNAYCAX116.6°120.6°
CAZNAYCBH118.2°119.7°
OBGCAXNAY122.4°119.8°
CAXNAYCBH125.2°119.7°
NBCCBDCBE118.0°120.0°
NBCCBDCAR123.4°120.0°
CBDNBCH21117.0°120.0°
NAYCBHCBI116.6°109.4°
NAYCBHH15107.7°109.5°
NAYCBHH16107.7°109.5°
CBDCBECBF121.9°120.1°
CBECBDCAR118.6°120.0°
CBDCBEH13119.0°120.0°
CBECBFCAT118.8°120.0°
CBFCBEH13119.0°120.0°
CBECBFH14120.6°120.0°
CBDCARCAS119.3°119.9°
CBDCARH8120.3°120.0°
CBICBHH15107.7°109.5°
CBICBHH16107.6°109.4°
CBHCBIH17109.5°109.5°
CBHCBIH18109.5°109.5°
CBHCBIH19109.5°109.4°
CBFCATCAS119.0°120.0°
CBFCATNAU119.6°120.0°
CATCBFH14120.6°120.0°
CARCASCAT122.3°120.0°
CARCASFAF114.8°120.0°
CASCARH8120.4°120.0°
CASCATNAU121.5°120.1°
CATCASFAF122.8°120.0°
CATNAUCAV119.6°111.0°
CATNAUCAG120.5°111.1°
NAUCAVCAW104.5°109.3°
CAVNAUCAG116.5°110.9°
NAUCAVH9110.7°109.5°
NAUCAVH10110.7°109.5°
CAVCAWNAI110.5°109.4°
CAWCAVH9110.7°109.5°
CAWCAVH10110.7°109.5°
CAVCAWH11109.2°109.5°
CAVCAWH12109.2°109.5°
NAUCAGCAH115.6°109.4°
NAUCAGH2107.9°109.5°
NAUCAGH22107.9°109.5°
CAGCAHNAI115.9°109.4°
CAHCAGH2107.9°109.5°
CAGCAHH3107.8°109.4°
CAHCAGH22107.9°109.5°
CAGCAHH23107.8°109.5°
CAWNAICAH119.9°110.8°
NAICAWH11109.2°109.5°
NAICAWH12109.2°109.4°
CAWNAIH20106.8°111.0°
NAICAHH3107.9°109.5°
CAHNAIH20106.8°111.0°
NAICAHH23107.9°109.5°
H2CAGH22109.5°109.5°
H3CAHH23109.4°109.5°
H9CAVH10109.5°109.5°
H11CAWH12109.5°109.5°
H15CBHH16109.5°109.5°
H17CBIH18109.5°109.5°
H17CBIH19109.5°109.4°
H18CBIH19109.4°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
CLAECADCACCAL178.2°179.9°
CLAECADCACCAB179.7°179.9°
CLAECADCALCAM1.8°0.1°
CLAECADCALCAK180.0°180.0°
CLAECADCACH10.3°0.0°
CADCACCABH1180.0°179.9°
CADCACCABCLAA179.6°179.7°
CADCACCABCAJ0.6°0.0°
CACCADCALCAM179.7°180.0°
CACCADCALCAK2.0°0.1°
CACCABCLAACAJ179.8°179.7°
CABCACCADCAL1.4°0.0°
CACCABCAJCAK0.2°0.0°
CACCABCAJH4179.8°180.0°
CLAACABCAJCAK180.0°179.7°
CLAACABCACH10.4°0.3°
CLAACABCAJH40.0°0.3°
CADCALCAMCAK178.3°179.9°
CADCALCAMCAN64.1°74.8°
CADCALCAKCAJ1.7°0.0°
CADCALCAMCAX114.9°104.9°
CALCADCACH1178.6°179.9°
CADCALCAKH5178.3°180.0°
CABCAJCAKCAL0.7°0.0°
CABCAJCAKH4180.0°180.0°
CAJCABCACH1179.4°180.0°
CABCAJCAKH5179.3°179.9°
CALCAMCANCAX179.0°179.7°
CALCAMCANCAO178.0°180.0°
CAMCALCAKCAJ180.0°180.0°
CALCAMCAXOBG2.0°0.0°
CALCAMCAXNAY178.4°180.0°
CAMCALCAKH50.0°0.1°
CALCAMCANH62.0°0.1°
CAKCALCAMCAN117.6°105.3°
CALCAKCAJH5180.0°179.9°
CAKCALCAMCAX63.4°75.0°
CALCAKCAJH4179.3°180.0°
CAMCANCAOH6180.0°179.9°
CAMCANCAOCAP179.3°179.9°
CAMCANCAOCAZ1.0°0.0°
CANCAMCAXOBG179.0°179.7°
CANCAMCAXNAY0.5°0.3°
CANCAOCAPNAQ179.5°180.0°
CANCAOCAPCAZ179.7°179.9°
CAOCANCAMCAX1.0°0.3°
CANCAOCAZNBA178.4°180.0°
CANCAOCAZNAY0.6°0.3°
CANCAOCAPH70.5°0.0°
NAQCAPCAOH7180.0°180.0°
NAQCAPCAOCAZ0.2°0.0°
CAPNAQCBBNBA0.5°0.0°
CAPNAQCBBNBC179.7°180.0°
CAOCAPNAQCBB0.7°0.0°
CAPCAOCAZNBA1.3°0.1°
CAPCAOCAZNAY179.7°179.7°
CAPCAOCANH60.7°0.0°
CAMCAXNAYCAZ0.0°0.0°
CAMCAXOBGNAY179.5°180.0°
CAMCAXNAYCBH177.4°179.9°
CAXCAMCANH6179.1°179.8°
NAQCBBNBANBC179.8°180.0°
NAQCBBNBACAZ0.7°0.0°
NAQCBBNBCCBD175.3°5.6°
CBBNAQCAPH7179.3°180.0°
NAQCBBNBCH214.7°174.4°
CAOCAZNBACBB1.6°0.1°
CAOCAZNBANAY179.0°179.7°
CAOCAZNAYCAX0.1°0.3°
CAOCAZNAYCBH177.6°179.6°
CAZCAOCANH6179.0°179.9°
CAZCAOCAPH7179.8°179.9°
CBBNBACAZNAY179.4°179.7°
NBACBBNBCCBD4.5°174.4°
NBACBBNBCH21175.5°5.6°
NBCCBBNBACAZ179.1°180.0°
CBBNBCCBDH21180.0°180.0°
CBBNBCCBDCBE158.3°146.4°
CBBNBCCBDCAR25.1°33.5°
NBACAZNAYCAX178.9°180.0°
NBACAZNAYCBH1.4°0.0°
CAZNAYCAXOBG179.5°180.0°
CAZNAYCAXCBH177.3°180.0°
CAZNAYCBHCBI149.1°90.0°
CAZNAYCBHH1528.0°150.0°
CAZNAYCBHH1689.9°30.0°
OBGCAXNAYCBH2.2°0.1°
CAXNAYCBHCBI33.7°90.0°
CAXNAYCBHH15154.7°29.9°
CAXNAYCBHH1687.4°150.0°
NBCCBDCBECAR176.8°180.0°
NBCCBDCBECBF178.4°179.5°
NBCCBDCARCAS178.5°180.0°
NBCCBDCARH81.5°0.4°
NBCCBDCBEH131.6°0.0°
NAYCBHCBIH15121.0°120.0°
NAYCBHCBIH16121.0°120.0°
NAYCBHH15H16116.8°120.1°
NAYCBHCBIH17180.0°180.0°
NAYCBHCBIH1860.0°60.0°
NAYCBHCBIH1960.0°60.0°
CBDCBECBFH13180.0°179.4°
CBDCBECBFCAT0.3°0.8°
CBECBDCARCAS1.9°0.1°
CBECBDCARH8178.1°179.6°
CBDCBECBFH14179.7°180.0°
CBECBDNBCH2121.7°33.6°
CBFCBECBDCAR1.6°0.5°
CBECBFCATH14180.0°179.2°
CBECBFCATCAS0.7°0.6°
CBECBFCATNAU179.4°179.5°
CBDCARCASH8180.0°179.6°
CBDCARCASCAT1.0°0.3°
CBDCARCASFAF179.8°179.7°
CARCBDCBEH13178.4°179.9°
CARCBDNBCH21154.9°146.4°
CBICBHH15H16116.8°120.0°
CBHCBIH17H18120.0°120.0°
CBHCBIH17H19120.0°120.0°
CBHCBIH18H19120.0°120.0°
CBFCATCASCAR0.4°0.0°
CBFCATCASNAU179.9°179.9°
CBFCATCASFAF178.8°179.9°
CBFCATNAUCAV120.9°60.1°
CBFCATNAUCAG37.6°63.7°
CATCBFCBEH13179.7°179.7°
CARCASCATFAF179.2°179.9°
CARCASCATNAU179.7°179.9°
CASCATNAUCAV59.2°120.0°
CASCATNAUCAG142.3°116.2°
CATCASCARH8179.0°179.9°
CASCATCBFH14179.3°179.7°
NAUCATCASFAF1.1°0.0°
CATNAUCAVCAG159.4°123.9°
CATNAUCAVCAW138.4°176.8°
CATNAUCAGCAH164.1°176.8°
CATNAUCAGH275.1°56.8°
CATNAUCAVH919.2°63.3°
CATNAUCAVH10102.4°56.8°
NAUCATCBFH140.6°0.3°
CATNAUCAGH2243.1°63.2°
FAFCASCARH80.2°0.2°
NAUCAVCAWH9119.2°119.9°
NAUCAVCAWH10119.2°120.0°
CAVNAUCAGCAH36.8°59.3°
NAUCAVCAWNAI63.7°58.4°
CAVNAUCAGH284.1°179.3°
NAUCAVH9H10122.3°120.1°
NAUCAVCAWH1156.4°61.6°
NAUCAVCAWH12176.1°178.3°
CAVNAUCAGH22157.7°60.7°
CAWCAVNAUCAG62.2°59.3°
CAVCAWNAIH11120.1°120.0°
CAVCAWNAIH12120.2°119.9°
CAVCAWNAICAH44.1°59.3°
CAWCAVH9H10122.3°120.1°
CAVCAWH11H12119.6°120.1°
CAVCAWNAIH20165.5°176.7°
NAUCAGCAHH2120.9°119.9°
NAUCAGCAHH22120.9°120.0°
NAUCAGCAHNAI11.1°58.4°
NAUCAGH2H22117.2°120.1°
NAUCAGCAHH3132.0°178.4°
CAGNAUCAVH9178.6°60.7°
CAGNAUCAVH1057.0°179.2°
NAUCAGCAHH23109.9°61.6°
CAGCAHNAICAW16.5°59.3°
CAGCAHNAIH3120.9°119.9°
CAGCAHNAIH23120.9°120.0°
CAHCAGH2H22117.2°120.1°
CAGCAHH3H23117.1°120.1°
CAGCAHNAIH20137.9°176.8°
CAWNAICAHH20121.4°123.9°
CAWNAICAHH3137.4°179.2°
NAICAWCAVH9177.1°61.5°
NAICAWCAVH1055.5°178.4°
NAICAWH11H12119.5°120.0°
CAWNAICAHH23104.5°60.7°
NAICAHCAGH2109.8°178.4°
NAICAHH3H23117.1°120.1°
CAHNAICAWH1176.0°60.7°
CAHNAICAWH12164.2°179.3°
NAICAHCAGH22132.0°61.6°
H2CAGCAHH311.2°61.7°
H2CAGCAHH23129.2°58.4°
H3CAHNAIH20101.1°56.9°
H3CAHCAGH22107.1°58.3°
H4CAJCAKH50.7°0.0°
H9CAVCAWH1162.8°178.5°
H9CAVCAWH1256.9°58.4°
H10CAVCAWH11175.6°58.4°
H10CAVCAWH1264.7°61.7°
H11CAWNAIH2045.4°63.2°
H12CAWNAIH2074.3°56.8°
H13CBECBFH140.3°0.6°
H15CBHCBIH1759.0°60.0°
H15CBHCBIH18179.0°60.0°
H15CBHCBIH1961.0°180.0°
H16CBHCBIH1759.0°60.0°
H16CBHCBIH1861.0°180.0°
H16CBHCBIH19179.0°60.0°
H17CBIH18H19120.0°120.0°
H20NAICAHH2317.0°63.2°
H22CAGCAHH2311.0°178.4°

218853

PDB entries from 2024-04-24

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