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7AJ

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
CBFNBCsing1.47Å1.47Å
NBCCBBsing1.47Å1.47Å
NBCCBDsing1.47Å1.47Å
CBBCBAsing1.53Å1.52Å
CAVOAUsing1.43Å1.43Å
CBDCBEsing1.53Å1.52Å
CBANAZsing1.47Å1.48Å
OAUCAQsing1.36Å1.36Å
CBENAZsing1.47Å1.48Å
NAZCAYsing1.47Å1.47Å
CAQCAPdoub1.38Å1.38ÅAromatic
CAQCARsing1.40Å1.38ÅAromatic
CAPCAOsing1.39Å1.33ÅAromatic
CAXCAYsing1.53Å1.53Å
CAXNAMsing1.46Å1.48Å
OATCARsing1.36Å1.36Å
OATCAWsing1.43Å1.43Å
CARCASdoub1.38Å1.39ÅAromatic
CAONAMsing1.38Å1.33ÅAromatic
CAOCANdoub1.40Å1.34ÅAromatic
NAMCALsing1.37Å1.33ÅAromatic
CANCASsing1.40Å1.34ÅAromatic
CANCAKsing1.47Å1.34ÅAromatic
CALCAKdoub1.36Å1.33ÅAromatic
CAKCAHsing1.48Å1.34Å
CAHCAIdoub1.36Å1.33ÅAromatic
CAHNAGsing1.38Å1.33ÅAromatic
CAICAEsing1.46Å1.34ÅAromatic
NAGCAFsing1.38Å1.33ÅAromatic
CAECAFdoub1.41Å1.34ÅAromatic
CAECADsing1.40Å1.34ÅAromatic
CAFNACsing1.33Å1.34ÅAromatic
CLJCADsing1.74Å1.73Å
CADCAAdoub1.38Å1.39ÅAromatic
NACCABdoub1.32Å1.39ÅAromatic
CAACABsing1.39Å1.38ÅAromatic
CBAH1sing1.09Å1.10Å
CBAH2sing1.09Å1.10Å
CBBH3sing1.09Å1.10Å
CBBH4sing1.09Å1.10Å
CBFH6sing1.09Å1.10Å
CBFH7sing1.09Å1.10Å
CBFH8sing1.09Å1.10Å
CBDH9sing1.09Å1.10Å
CBDH10sing1.09Å1.10Å
CBEH11sing1.09Å1.10Å
CBEH12sing1.09Å1.10Å
CAYH14sing1.09Å1.10Å
CAYH15sing1.09Å1.10Å
CAXH16sing1.09Å1.10Å
CAXH17sing1.09Å1.10Å
CALH18sing1.08Å1.08Å
CAPH19sing1.08Å1.08Å
CAVH20sing1.09Å1.10Å
CAVH21sing1.09Å1.10Å
CAVH22sing1.09Å1.10Å
CAWH23sing1.09Å1.10Å
CAWH24sing1.09Å1.10Å
CAWH25sing1.09Å1.10Å
CASH26sing1.08Å1.08Å
CAIH27sing1.08Å1.08Å
CAAH28sing1.08Å1.08Å
CABH29sing1.08Å1.08Å
NAGH30sing0.97Å1.00Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
CBFNBCCBB108.0°111.0°
CBFNBCCBD109.2°111.0°
NBCCBFH6109.5°109.5°
NBCCBFH7109.4°109.4°
NBCCBFH8109.5°109.5°
CBBNBCCBD108.3°110.9°
NBCCBBCBA110.0°109.4°
NBCCBBH3109.3°109.5°
NBCCBBH4109.3°109.5°
NBCCBDCBE109.7°109.4°
NBCCBDH9109.4°109.5°
NBCCBDH10109.4°109.4°
CBBCBANAZ109.9°109.4°
CBBCBAH1109.4°109.5°
CBBCBAH2109.4°109.5°
CBACBBH3109.3°109.5°
CBACBBH4109.3°109.5°
CAVOAUCAQ111.7°117.0°
OAUCAVH20109.5°109.5°
OAUCAVH21109.4°109.5°
OAUCAVH22109.5°109.5°
CBDCBENAZ109.9°109.4°
CBECBDH9109.4°109.6°
CBECBDH10109.4°109.5°
CBDCBEH11109.4°109.4°
CBDCBEH12109.4°109.5°
CBANAZCBE108.8°110.9°
CBANAZCAY109.7°111.0°
NAZCBAH1109.3°109.5°
NAZCBAH2109.4°109.5°
OAUCAQCAP124.3°119.8°
OAUCAQCAR116.9°119.7°
CBENAZCAY110.9°111.0°
NAZCBEH11109.4°109.5°
NAZCBEH12109.4°109.5°
NAZCAYCAX115.3°109.5°
NAZCAYH14108.0°109.4°
NAZCAYH15108.0°109.5°
CAPCAQCAR118.8°120.5°
CAQCAPCAO119.4°120.0°
CAQCAPH19120.3°120.0°
CAQCAROAT116.2°119.9°
CAQCARCAS119.2°120.2°
CAPCAONAM128.8°133.1°
CAPCAOCAN122.5°119.5°
CAOCAPH19120.3°120.0°
CAYCAXNAM106.4°109.5°
CAXCAYH14108.0°109.5°
CAXCAYH15108.0°109.5°
CAYCAXH16110.2°109.5°
CAYCAXH17110.2°109.5°
CAXNAMCAO116.7°124.9°
CAXNAMCAL134.4°125.0°
NAMCAXH16110.2°109.5°
NAMCAXH17110.2°109.5°
CAROATCAW112.2°117.0°
OATCARCAS124.6°119.9°
OATCAWH23109.5°109.5°
OATCAWH24109.5°109.5°
OATCAWH25109.5°109.5°
CARCASCAN119.9°119.7°
CARCASH26120.0°120.2°
NAMCAOCAN108.7°107.4°
CAONAMCAL108.8°110.1°
CAOCANCAS120.1°120.1°
CAOCANCAK106.2°106.1°
NAMCALCAK106.8°109.8°
NAMCALH18126.6°125.1°
CASCANCAK133.7°133.8°
CANCASH26120.0°120.1°
CANCAKCAL109.6°106.6°
CANCAKCAH128.4°126.7°
CALCAKCAH122.0°126.7°
CAKCALH18126.6°125.1°
CAKCAHCAI128.3°125.2°
CAKCAHNAG122.7°125.3°
CAICAHNAG108.9°109.5°
CAHCAICAE107.5°106.8°
CAHCAIH27126.3°126.7°
CAHNAGCAF107.6°109.9°
CAHNAGH30126.2°125.0°
CAICAECAF107.7°106.5°
CAICAECAD131.7°134.1°
CAECAIH27126.2°126.5°
NAGCAFCAE108.3°107.3°
NAGCAFNAC130.6°132.9°
CAFNAGH30126.2°125.0°
CAFCAECAD120.5°119.4°
CAECAFNAC121.1°119.8°
CAECADCLJ120.8°121.0°
CAECADCAA120.8°118.0°
CAFNACCAB120.5°121.7°
CLJCADCAA118.4°121.0°
CADCAACAB118.9°119.4°
CADCAAH28120.5°120.3°
NACCABCAA118.1°121.6°
NACCABH29120.9°119.2°
CABCAAH28120.5°120.3°
CAACABH29121.0°119.2°
H1CBAH2109.5°109.5°
H3CBBH4109.5°109.5°
H6CBFH7109.5°109.5°
H6CBFH8109.5°109.5°
H7CBFH8109.4°109.5°
H9CBDH10109.4°109.5°
H11CBEH12109.4°109.5°
H14CAYH15109.5°109.5°
H16CAXH17109.5°109.4°
H20CAVH21109.5°109.4°
H20CAVH22109.5°109.5°
H21CAVH22109.5°109.5°
H23CAWH24109.4°109.4°
H23CAWH25109.5°109.5°
H24CAWH25109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
CBFNBCCBBCBD118.2°123.9°
CBFNBCCBBCBA178.7°176.8°
CBFNBCCBDCBE177.9°176.8°
CBFNBCCBBH358.6°56.8°
CBFNBCCBBH461.2°63.2°
NBCCBFH6H7120.0°120.0°
NBCCBFH6H8120.0°120.0°
NBCCBFH7H8120.0°120.0°
CBFNBCCBDH962.1°56.7°
CBFNBCCBDH1057.8°63.2°
NBCCBBCBAH3120.1°120.0°
NBCCBBCBAH4120.1°120.0°
CBBNBCCBDCBE60.5°59.2°
NBCCBBCBANAZ60.7°58.4°
NBCCBBCBAH1179.3°178.4°
NBCCBBCBAH259.4°61.6°
NBCCBBH3H4119.8°120.0°
CBBNBCCBFH6180.0°60.0°
CBBNBCCBFH760.0°180.0°
CBBNBCCBFH860.0°60.0°
CBBNBCCBDH9179.4°179.3°
CBBNBCCBDH1059.6°60.7°
CBDNBCCBBCBA60.6°59.2°
NBCCBDCBEH9120.0°120.0°
NBCCBDCBEH10120.1°119.9°
NBCCBDCBENAZ60.7°58.3°
CBDNBCCBBH359.5°179.2°
CBDNBCCBBH4179.4°60.8°
CBDNBCCBFH662.5°63.8°
CBDNBCCBFH7177.5°56.2°
CBDNBCCBFH857.6°176.2°
NBCCBDH9H10119.9°119.9°
NBCCBDCBEH1159.4°61.6°
NBCCBDCBEH12179.3°178.4°
CBBCBANAZH1120.1°120.0°
CBBCBANAZH2120.1°120.0°
CBBCBANAZCBE59.1°59.3°
CBBCBANAZCAY179.5°176.8°
CBBCBAH1H2119.8°120.0°
CBACBBH3H4119.7°120.1°
CAVOAUCAQCAP0.3°0.1°
CAVOAUCAQCAR178.3°180.0°
OAUCAVH20H21120.0°120.0°
OAUCAVH20H22120.0°120.1°
OAUCAVH21H22120.0°120.1°
CBDCBENAZCBA59.2°59.3°
CBDCBENAZH11120.1°119.9°
CBDCBENAZH12120.1°120.0°
CBDCBENAZCAY179.9°176.8°
CBECBDH9H10119.9°120.1°
CBDCBEH11H12119.8°120.1°
CBANAZCBECAY120.7°123.9°
CBANAZCAYCAX65.4°170.0°
NAZCBAH1H2119.8°120.1°
NAZCBACBBH359.4°178.4°
NAZCBACBBH4179.2°61.6°
CBANAZCBEH1160.9°60.6°
CBANAZCBEH12179.3°179.3°
CBANAZCAYH14173.7°50.0°
CBANAZCAYH1555.4°70.0°
OAUCAQCAPCAR178.0°179.9°
OAUCAQCAPCAO179.2°180.0°
OAUCAQCAROAT1.2°0.0°
OAUCAQCARCAS179.0°180.0°
OAUCAQCAPH190.8°0.0°
CAQOAUCAVH20180.0°60.0°
CAQOAUCAVH2160.0°59.9°
CAQOAUCAVH2260.0°180.0°
CBENAZCAYCAX54.7°66.2°
CBENAZCBAH1179.1°179.3°
CBENAZCBAH261.0°60.7°
NAZCBECBDH9179.3°178.4°
NAZCBECBDH1059.4°61.6°
NAZCBEH11H12119.8°120.1°
CBENAZCAYH1466.2°173.8°
CBENAZCAYH15175.5°53.8°
NAZCAYCAXH14120.9°120.0°
NAZCAYCAXH15120.8°120.0°
NAZCAYCAXNAM174.9°180.0°
CAYNAZCBAH159.4°56.9°
CAYNAZCBAH260.4°63.2°
CAYNAZCBEH1159.8°63.3°
CAYNAZCBEH1260.1°56.8°
NAZCAYH14H15117.3°120.0°
NAZCAYCAXH1655.4°60.0°
NAZCAYCAXH1765.5°60.0°
CAQCAPCAOH19180.0°180.0°
CAPCAQCAROAT179.3°180.0°
CAPCAQCARCAS0.9°0.1°
CAQCAPCAONAM179.7°180.0°
CAQCAPCAOCAN0.9°0.1°
CARCAQCAPCAO1.3°0.1°
CAQCAROATCAS179.8°180.0°
CAQCAROATCAW179.8°180.0°
CAQCARCASCAN0.2°0.0°
CARCAQCAPH19178.7°180.0°
CAQCARCASH26179.8°180.0°
CAPCAONAMCAX2.9°0.0°
CAPCAONAMCAN178.9°180.0°
CAPCAONAMCAL179.9°179.8°
CAPCAOCANCAS0.2°0.0°
CAPCAOCANCAK179.4°179.8°
CAYCAXNAMH16119.5°120.0°
CAYCAXNAMH17119.5°120.0°
CAYCAXNAMCAO115.3°84.7°
CAYCAXNAMCAL61.1°95.0°
CAXCAYH14H15117.4°120.0°
CAYCAXH16H17121.4°120.0°
CAXNAMCAOCAL177.2°179.7°
CAXNAMCAOCAN178.2°180.0°
CAXNAMCALCAK177.7°180.0°
NAMCAXCAYH1464.2°60.0°
NAMCAXCAYH1554.1°60.0°
NAMCAXH16H17121.4°120.0°
CAXNAMCALH182.3°0.0°
OATCARCASCAN180.0°180.0°
CAROATCAWH23180.0°180.0°
CAROATCAWH2460.0°60.0°
CAROATCAWH2560.0°60.0°
OATCARCASH260.0°0.0°
CAWOATCARCAS0.1°0.0°
OATCAWH23H24120.0°120.0°
OATCAWH23H25120.0°120.0°
OATCAWH24H25120.0°120.0°
CARCASCANCAO0.2°0.0°
CARCASCANH26180.0°180.0°
CARCASCANCAK179.6°179.8°
NAMCAOCANCAS179.2°180.0°
NAMCAOCANCAK0.4°0.1°
CAONAMCALCAK1.2°0.2°
CAONAMCAXH164.3°35.3°
CAONAMCAXH17125.2°155.3°
CAONAMCALH18178.8°179.7°
NAMCAOCAPH190.3°0.0°
CANCAONAMCAL1.0°0.2°
CAOCANCASCAK179.4°179.8°
CAOCANCAKCAL0.4°0.0°
CAOCANCAKCAH178.8°179.9°
CANCAOCAPH19179.1°180.0°
CAOCANCASH26179.8°180.0°
NAMCALCAKCAN0.9°0.1°
NAMCALCAKH18180.0°179.9°
NAMCALCAKCAH179.5°180.0°
CALNAMCAXH16179.4°145.0°
CALNAMCAXH1758.4°25.0°
CASCANCAKCAL179.8°179.9°
CASCANCAKCAH1.7°0.0°
CANCAKCALCAH178.6°179.9°
CANCAKCAHCAI4.1°140.2°
CANCAKCAHNAG179.5°40.2°
CANCAKCALH18179.0°179.8°
CAKCANCASH260.4°0.2°
CALCAKCAHCAI174.2°40.0°
CALCAKCAHNAG1.2°139.7°
CAKCAHCAINAG175.9°179.7°
CAKCAHCAICAE177.7°180.0°
CAKCAHNAGCAF178.0°179.8°
CAHCAKCALH180.5°0.1°
CAKCAHCAIH272.3°0.0°
CAKCAHNAGH302.1°0.0°
CAHCAICAEH27180.0°180.0°
CAICAHNAGCAF1.7°0.5°
CAHCAICAECAF1.0°0.0°
CAHCAICAECAD179.1°179.9°
CAICAHNAGH30178.3°179.7°
NAGCAHCAICAE1.7°0.3°
CAHNAGCAFH30180.0°179.8°
CAHNAGCAFCAE1.1°0.5°
CAHNAGCAFNAC179.1°179.8°
NAGCAHCAIH27178.3°179.7°
CAICAECAFNAG0.0°0.3°
CAICAECAFCAD179.9°180.0°
CAICAECAFNAC179.8°180.0°
CAICAECADCLJ0.0°0.1°
CAICAECADCAA179.6°179.9°
NAGCAFCAENAC179.8°179.7°
NAGCAFCAECAD179.9°179.8°
NAGCAFNACCAB179.8°179.6°
CAFCAECADCLJ179.9°180.0°
CAFCAECADCAA0.2°0.0°
CAECAFNACCAB0.1°0.0°
CAFCAECAIH27179.0°180.0°
CAECAFNAGH30178.9°179.7°
CADCAECAFNAC0.1°0.0°
CAECADCLJCAA179.6°180.0°
CAECADCAACAB0.4°0.0°
CADCAECAIH270.9°0.0°
CAECADCAAH28179.6°180.0°
CAFNACCABCAA0.2°0.1°
CAFNACCABH29179.8°180.0°
NACCAFNAGH300.8°0.0°
CLJCADCAACAB179.9°179.9°
CLJCADCAAH280.1°0.0°
CADCAACABNAC0.4°0.1°
CADCAACABH28180.0°179.9°
CADCAACABH29179.6°180.0°
NACCABCAAH29180.0°179.9°
NACCABCAAH28179.6°180.0°
H1CBACBBH360.6°61.7°
H1CBACBBH459.2°58.4°
H2CBACBBH3179.5°58.3°
H2CBACBBH460.7°178.4°
H6CBFH7H8120.0°120.0°
H9CBDCBEH1160.6°58.4°
H9CBDCBEH1259.2°61.6°
H10CBDCBEH11179.5°178.5°
H10CBDCBEH1260.7°58.5°
H14CAYCAXH16176.3°180.0°
H14CAYCAXH1755.3°60.0°
H15CAYCAXH1665.4°60.0°
H15CAYCAXH17173.6°180.0°
H20CAVH21H22120.0°120.0°
H23CAWH24H25120.0°120.0°
H28CAACABH290.4°0.0°

222415

PDB entries from 2024-07-10

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