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453

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
OATCAPdoub1.22Å1.23Å
CAPNAOsing1.35Å1.35Å
CAPNAQsing1.34Å1.31Å
NAOCANsing1.47Å1.46Å
NAQCARsing1.37Å1.42Å
CANCAMsing1.52Å1.47Å
CANCAUsing1.51Å1.47Å
CARCAMdoub1.35Å1.40Å
CARCASsing1.51Å1.49Å
OALCAKdoub1.22Å1.22Å
CAMCAKsing1.42Å1.48Å
CAKNAJsing1.35Å1.31Å
CAUCAZdoub1.38Å1.37ÅAromatic
CAUCAVsing1.38Å1.39ÅAromatic
CAZCAYsing1.40Å1.38ÅAromatic
CAVCAWdoub1.38Å1.38ÅAromatic
CAFCAGdoub1.38Å1.41ÅAromatic
CAFCADsing1.40Å1.39ÅAromatic
NAJCAGsing1.40Å1.35Å
CACCADsing1.46Å1.42ÅAromatic
CACNABdoub1.30Å1.37ÅAromatic
CAYCBBsing1.48Å1.50Å
CAYCAXdoub1.40Å1.35ÅAromatic
CAGCAHsing1.39Å1.41ÅAromatic
CADCAEdoub1.41Å1.46ÅAromatic
CAWCAXsing1.38Å1.38ÅAromatic
CBBOBCdoub1.22Å1.20Å
CBBNBDsing1.35Å1.32Å
NBDCBEsing1.46Å1.44Å
CAXFBAsing1.35Å1.32Å
NABNAAsing1.40Å1.41ÅAromatic
CBECBFsing1.51Å1.51Å
CAHCAIdoub1.36Å1.39ÅAromatic
CAENAAsing1.37Å1.33ÅAromatic
CAECAIsing1.39Å1.38ÅAromatic
CBFCBKdoub1.38Å1.38ÅAromatic
CBFNBGsing1.32Å1.34ÅAromatic
CBKCBJsing1.39Å1.39ÅAromatic
NBGCBHdoub1.32Å1.34ÅAromatic
CBJCBIdoub1.39Å1.39ÅAromatic
CBHCBIsing1.38Å1.39ÅAromatic
NBDH1sing0.97Å1.00Å
CBEH2sing1.09Å1.10Å
CBEH3sing1.09Å1.10Å
CBKH4sing1.08Å1.08Å
CBJH5sing1.08Å1.08Å
CBIH6sing1.08Å1.08Å
CBHH7sing1.08Å1.08Å
CAZH8sing1.08Å1.08Å
CAWH9sing1.08Å1.08Å
CAVH10sing1.08Å1.08Å
CANH11sing1.09Å1.10Å
NAOH12sing0.97Å1.00Å
NAQH13sing0.97Å1.00Å
CASH14sing1.09Å1.10Å
CASH15sing1.09Å1.10Å
CASH16sing1.09Å1.10Å
NAJH17sing0.97Å1.00Å
CAFH18sing1.08Å1.08Å
CAHH19sing1.08Å1.08Å
CAIH20sing1.08Å1.08Å
NAAH21sing0.97Å1.00Å
CACH22sing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
OATCAPNAO121.8°119.0°
OATCAPNAQ118.8°118.9°
NAOCAPNAQ119.4°122.1°
CAPNAOCAN126.5°118.5°
CAPNAOH12116.8°120.7°
CAPNAQCAR117.7°123.6°
CAPNAQH13121.2°118.2°
NAOCANCAM110.3°116.9°
NAOCANCAU110.9°108.0°
NAOCANH11108.0°107.9°
CANNAOH12116.8°120.8°
NAQCARCAM124.5°121.1°
NAQCARCAS108.7°119.5°
CARNAQH13121.2°118.2°
CAMCANCAU111.8°107.9°
CANCAMCAR116.6°117.7°
CANCAMCAK133.5°121.2°
CAMCANH11107.8°107.9°
CANCAUCAZ122.1°119.9°
CANCAUCAV117.6°119.9°
CAUCANH11107.9°107.8°
CAMCARCAS126.8°119.5°
CARCAMCAK109.8°121.1°
CARCASH14109.5°109.5°
CARCASH15109.5°109.5°
CARCASH16109.5°109.4°
OALCAKCAM112.4°120.0°
OALCAKNAJ125.1°120.0°
CAMCAKNAJ122.4°120.0°
CAKNAJCAG123.1°120.0°
CAKNAJH17118.5°120.0°
CAZCAUCAV120.3°120.2°
CAUCAZCAY120.1°119.9°
CAUCAZH8119.9°120.1°
CAUCAVCAW118.8°120.4°
CAUCAVH10120.6°119.8°
CAZCAYCBB118.9°120.2°
CAZCAYCAX119.6°119.7°
CAYCAZH8119.9°120.1°
CAVCAWCAX120.0°120.1°
CAVCAWH9120.0°119.9°
CAWCAVH10120.6°119.8°
CAGCAFCAD118.6°119.4°
CAFCAGNAJ127.1°119.8°
CAFCAGCAH119.2°120.3°
CAGCAFH18120.7°120.3°
CAFCADCAC131.7°133.9°
CAFCADCAE120.6°119.7°
CADCAFH18120.7°120.2°
NAJCAGCAH113.3°119.9°
CAGNAJH17118.4°120.0°
CADCACNAB107.9°107.8°
CACCADCAE107.7°106.3°
CADCACH22126.0°126.1°
CACNABNAA106.9°110.1°
NABCACH22126.1°126.1°
CBBCAYCAX121.5°120.1°
CAYCBBOBC118.4°120.0°
CAYCBBNBD121.2°120.0°
CAYCAXCAW121.2°119.7°
CAYCAXFBA119.6°120.1°
CAGCAHCAI123.3°120.8°
CAGCAHH19118.4°119.6°
CADCAENAA104.4°106.7°
CADCAECAI119.8°119.6°
CAWCAXFBA119.2°120.1°
CAXCAWH9120.0°119.9°
OBCCBBNBD120.4°120.0°
CBBNBDCBE122.6°120.0°
CBBNBDH1118.7°120.0°
NBDCBECBF111.9°109.5°
CBENBDH1118.7°120.0°
NBDCBEH2108.8°109.5°
NBDCBEH3108.9°109.5°
NABNAACAE113.2°109.0°
NABNAAH21123.4°125.4°
CBECBFCBK119.2°119.6°
CBECBFNBG121.1°119.6°
CBFCBEH2108.9°109.5°
CBFCBEH3108.8°109.5°
CAHCAICAE118.3°120.1°
CAICAHH19118.4°119.6°
CAHCAIH20120.8°119.9°
NAACAECAI135.8°133.6°
CAENAAH21123.4°125.5°
CAECAIH20120.8°120.0°
CBKCBFNBG119.7°120.8°
CBFCBKCBJ120.5°119.2°
CBFCBKH4119.8°120.4°
CBFNBGCBH121.5°121.7°
CBKCBJCBI118.2°118.4°
CBJCBKH4119.8°120.4°
CBKCBJH5120.9°120.8°
NBGCBHCBI120.8°120.8°
NBGCBHH7119.6°119.6°
CBJCBICBH119.3°119.2°
CBICBJH5120.9°120.8°
CBJCBIH6120.4°120.4°
CBHCBIH6120.4°120.4°
CBICBHH7119.6°119.6°
H2CBEH3109.5°109.5°
H14CASH15109.5°109.5°
H14CASH16109.4°109.5°
H15CASH16109.5°109.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
OATCAPNAONAQ178.5°180.0°
OATCAPNAOCAN170.0°180.0°
OATCAPNAQCAR169.8°180.0°
OATCAPNAOH1210.0°0.1°
OATCAPNAQH1310.2°0.0°
CAPNAOCANH12180.0°179.9°
NAOCAPNAQCAR8.8°0.0°
CAPNAOCANCAM24.8°0.0°
CAPNAOCANCAU99.6°121.9°
CAPNAOCANH11142.4°121.8°
NAOCAPNAQH13171.2°180.0°
NAQCAPNAOCAN11.5°0.0°
CAPNAQCARH13180.0°180.0°
CAPNAQCARCAM14.1°0.0°
CAPNAQCARCAS163.7°180.0°
NAQCAPNAOH12168.5°179.9°
NAOCANCAMCAU123.9°121.9°
NAOCANCAMH11117.7°121.8°
NAOCANCAUH11118.1°116.4°
NAOCANCAMCAR17.7°0.0°
NAOCANCAMCAK157.9°180.0°
NAOCANCAUCAZ26.6°124.2°
NAOCANCAUCAV152.6°55.7°
NAQCARCAMCAN0.8°0.0°
NAQCARCAMCAS177.4°180.0°
NAQCARCAMCAK175.8°180.0°
NAQCARCASH14180.0°0.0°
NAQCARCASH1560.0°120.0°
NAQCARCASH1660.0°120.0°
CAMCANCAUH11118.4°116.3°
CANCAMCARCAK176.6°180.0°
CANCAMCARCAS178.2°180.0°
CANCAMCAKOAL63.7°86.1°
CANCAMCAKNAJ118.7°93.8°
CAMCANCAUCAZ97.0°108.5°
CAMCANCAUCAV83.9°71.6°
CAMCANNAOH12155.2°180.0°
CAUCANCAMCAR106.2°121.9°
CAUCANCAMCAK78.2°58.1°
CANCAUCAZCAV179.1°179.9°
CANCAUCAZCAY179.7°180.0°
CANCAUCAVCAW179.5°179.7°
CANCAUCAZH80.3°0.0°
CANCAUCAVH100.5°0.1°
CAUCANNAOH1280.4°58.1°
CARCAMCAKOAL112.1°93.9°
CARCAMCAKNAJ65.5°86.2°
CARCAMCANH11135.4°121.8°
CAMCARNAQH13165.9°180.0°
CAMCARCASH142.3°180.0°
CAMCARCASH15122.3°60.0°
CAMCARCASH16117.7°60.0°
CASCARCAMCAK1.6°0.0°
CASCARNAQH1316.3°0.0°
CARCASH14H15120.0°120.0°
CARCASH14H16120.0°120.0°
CARCASH15H16120.0°119.9°
OALCAKCAMNAJ177.6°180.0°
OALCAKNAJCAG3.3°8.0°
OALCAKNAJH17176.7°172.0°
CAMCAKNAJCAG174.0°171.9°
CAKCAMCANH1140.2°58.1°
CAMCAKNAJH175.9°8.1°
CAKNAJCAGCAF1.4°146.9°
CAKNAJCAGH17180.0°180.0°
CAKNAJCAGCAH171.4°33.4°
CAUCAZCAYH8180.0°180.0°
CAZCAUCAVCAW0.4°0.3°
CAUCAZCAYCBB180.0°180.0°
CAUCAZCAYCAX0.6°0.2°
CAZCAUCAVH10179.6°180.0°
CAZCAUCANH11144.6°7.8°
CAVCAUCAZCAY0.6°0.1°
CAUCAVCAWH10180.0°179.6°
CAUCAVCAWCAX0.1°0.3°
CAVCAUCAZH8179.4°180.0°
CAUCAVCAWH9179.9°179.7°
CAVCAUCANH1134.5°172.1°
CAZCAYCBBCAX179.4°179.7°
CAZCAYCAXCAW0.3°0.2°
CAZCAYCBBOBC122.8°179.7°
CAZCAYCBBNBD56.5°0.0°
CAZCAYCAXFBA179.6°179.8°
CAVCAWCAXCAY0.1°0.0°
CAVCAWCAXH9180.0°180.0°
CAVCAWCAXFBA179.9°179.9°
CAGCAFCADH18180.0°179.9°
CAFCAGNAJCAH172.8°179.6°
CAGCAFCADCAC178.1°179.9°
CAGCAFCADCAE2.0°0.2°
CAFCAGCAHCAI3.6°0.3°
CAFCAGNAJH17178.6°33.1°
CAFCAGCAHH19176.4°179.7°
CADCAFCAGNAJ176.0°180.0°
CAFCADCACCAE179.9°179.9°
CAFCADCACNAB179.8°179.8°
CADCAFCAGCAH3.6°0.4°
CAFCADCAENAA179.6°179.9°
CAFCADCAECAI0.2°0.1°
CAFCADCACH220.3°0.0°
NAJCAGCAHCAI177.0°179.9°
NAJCAGCAFH184.0°0.1°
NAJCAGCAHH193.0°0.1°
CADCACNABH22180.0°179.8°
CADCACNABNAA0.0°0.4°
CACCADCAENAA0.3°0.0°
CACCADCAECAI179.9°179.8°
CACCADCAFH181.9°0.1°
NABCACCADCAE0.2°0.3°
CACNABNAACAE0.2°0.4°
CACNABNAAH21179.8°179.6°
CBBCAYCAXCAW179.7°180.0°
CAYCBBOBCNBD179.3°179.7°
CAYCBBNBDCBE179.7°179.7°
CBBCAYCAXFBA0.2°0.1°
CAYCBBNBDH10.3°0.3°
CBBCAYCAZH80.0°0.0°
CAYCAXCAWFBA179.9°180.0°
CAXCAYCBBOBC56.6°0.0°
CAXCAYCBBNBD124.1°179.7°
CAXCAYCAZH8179.4°179.7°
CAYCAXCAWH9179.9°180.0°
CAGCAHCAIH19180.0°180.0°
CAGCAHCAICAE1.7°0.0°
CAHCAGNAJH178.6°146.6°
CAHCAGCAFH18176.4°179.8°
CAGCAHCAIH20178.3°180.0°
CADCAENAANAB0.3°0.2°
CADCAECAICAH0.0°0.2°
CADCAENAACAI179.8°179.8°
CAECADCAFH18178.0°180.0°
CADCAECAIH20180.0°179.8°
CADCAENAAH21179.7°179.8°
CAECADCACH22179.8°179.9°
CAXCAWCAVH10179.9°180.0°
OBCCBBNBDCBE0.4°0.0°
OBCCBBNBDH1179.6°180.0°
CBBNBDCBEH1180.0°180.0°
CBBNBDCBECBF83.5°180.0°
CBBNBDCBEH236.8°60.0°
CBBNBDCBEH3156.1°60.0°
NBDCBECBFH2120.4°120.0°
NBDCBECBFH3120.4°120.0°
NBDCBECBFCBK150.1°95.0°
NBDCBECBFNBG30.3°85.3°
NBDCBEH2H3118.9°120.0°
FBACAXCAWH90.1°0.0°
NABNAACAEH21180.0°180.0°
NABNAACAECAI179.9°180.0°
NAANABCACH22180.0°179.8°
CBECBFCBKNBG179.6°179.7°
CBECBFCBKCBJ180.0°180.0°
CBECBFNBGCBH179.7°179.7°
CBFCBENBDH196.5°0.0°
CBFCBEH2H3118.9°120.0°
CBECBFCBKH40.0°0.0°
CAHCAICAENAA179.8°180.0°
CAHCAICAEH20180.0°180.0°
NAACAECAIH200.2°0.0°
CAECAICAHH19178.3°180.0°
CAICAENAAH210.1°0.0°
CBFCBKCBJH4180.0°179.9°
CBKCBFNBGCBH0.1°0.5°
CBFCBKCBJCBI0.5°0.0°
CBKCBFCBEH229.7°25.0°
CBKCBFCBEH389.5°145.0°
CBFCBKCBJH5179.4°180.0°
NBGCBFCBKCBJ0.4°0.3°
CBFNBGCBHCBI0.2°0.5°
NBGCBFCBEH2150.7°154.7°
NBGCBFCBEH390.1°34.7°
NBGCBFCBKH4179.6°179.7°
CBFNBGCBHH7179.8°179.7°
CBKCBJCBIH5180.0°180.0°
CBKCBJCBICBH0.3°0.0°
CBKCBJCBIH6179.8°180.0°
NBGCBHCBICBJ0.1°0.2°
NBGCBHCBIH7180.0°179.8°
NBGCBHCBIH6179.9°179.7°
CBJCBICBHH6180.0°180.0°
CBICBJCBKH4179.5°180.0°
CBJCBICBHH7179.9°180.0°
CBHCBICBJH5179.7°179.9°
H1NBDCBEH2143.2°120.0°
H1NBDCBEH323.9°120.0°
H4CBKCBJH50.5°0.0°
H5CBJCBIH60.3°0.0°
H6CBICBHH70.1°0.1°
H9CAWCAVH100.1°0.1°
H11CANNAOH1237.6°58.2°
H14CASH15H16120.0°120.0°
H19CAHCAIH201.7°0.0°

222415

PDB entries from 2024-07-10

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