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093

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
OAMSANdoub1.42Å1.49Å
SANOAOdoub1.42Å1.49Å
SANNAUsing1.66Å1.52Å
SANCAFsing1.76Å1.77Å
NAUCAVsing1.46Å1.46Å
NAUHAUsing0.97Å1.02Å
CAVCAWsing1.53Å1.53Å
CAVHAV1sing1.09Å1.11Å
CAVHAV2sing1.09Å1.12Å
CAWOAXsing1.43Å1.42Å
CAWHAW1sing1.09Å1.12Å
CAWHAW2sing1.09Å1.11Å
OAXHAXsing0.97Å0.95Å
CAFCABdoub1.38Å1.40ÅAromatic
CAFCAGsing1.38Å1.40ÅAromatic
CABCLsing1.74Å1.73Å
CABCACsing1.38Å1.39ÅAromatic
CACCADdoub1.38Å1.39ÅAromatic
CACHACsing1.08Å1.10Å
CADCAHsing1.40Å1.39ÅAromatic
CADHADsing1.08Å1.10Å
CAGCAHdoub1.40Å1.40ÅAromatic
CAGHAGsing1.08Å1.10Å
CAHCAIsing1.48Å1.40ÅAromatic
CAICAJdoub1.35Å1.39ÅAromatic
CAISAPsing1.78Å1.71ÅAromatic
CAJCAEsing1.51Å1.53Å
CAJNAKsing1.35Å1.33ÅAromatic
CAEHAE1sing1.09Å1.11Å
CAEHAE2sing1.09Å1.12Å
CAEHAE3sing1.09Å1.11Å
NAKCAQsing1.36Å1.33ÅAromatic
NAKHAKsing0.97Å1.02Å
SAPCAQsing1.74Å1.72ÅAromatic
CAQNARdoub1.33Å1.34Å
NARCASsing1.33Å1.34Å
CASOALdoub1.22Å1.22Å
CASCATsing1.51Å1.50Å
CATHAT1sing1.09Å1.11Å
CATHAT2sing1.09Å1.12Å
CATHAT3sing1.09Å1.11Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
OAMSANOAO107.9°125.3°
OAMSANNAU110.2°105.8°
OAMSANCAF108.5°105.8°
OAOSANNAU108.1°105.7°
OAOSANCAF109.4°105.7°
NAUSANCAF112.7°107.4°
SANNAUCAV120.5°120.0°
SANNAUHAU119.8°120.0°
SANCAFCAB121.7°120.0°
SANCAFCAG120.7°119.9°
CAVNAUHAU119.7°120.1°
NAUCAVCAW106.1°109.4°
NAUCAVHAV1113.5°109.5°
NAUCAVHAV2113.5°109.5°
CAWCAVHAV1113.5°109.5°
CAWCAVHAV2113.5°109.5°
CAVCAWOAX110.1°109.5°
CAVCAWHAW1112.0°109.5°
CAVCAWHAW2112.0°109.5°
HAV1CAVHAV297.0°109.5°
OAXCAWHAW1112.0°109.4°
OAXCAWHAW2111.9°109.4°
CAWOAXHAX110.1°106.9°
HAW1CAWHAW298.4°109.5°
CABCAFCAG117.6°120.1°
CAFCABCL120.9°119.8°
CAFCABCAC120.8°120.3°
CAFCAGCAH122.1°119.8°
CAFCAGHAG118.9°120.1°
CLCABCAC118.3°119.9°
CABCACCAD120.7°120.1°
CABCACHAC119.6°120.0°
CADCACHAC119.7°119.9°
CACCADCAH119.9°119.8°
CACCADHAD120.1°120.1°
CAHCADHAD120.1°120.1°
CADCAHCAG118.8°119.8°
CADCAHCAI121.0°120.1°
CAHCAGHAG118.9°120.1°
CAGCAHCAI120.1°120.1°
CAHCAICAJ126.8°129.0°
CAHCAISAP120.8°129.1°
CAJCAISAP112.4°101.9°
CAICAJCAE126.9°120.8°
CAICAJNAK112.7°118.3°
CAISAPCAQ87.3°98.2°
CAECAJNAK120.3°120.8°
CAJCAEHAE1126.9°109.5°
CAJCAEHAE2106.1°109.4°
CAJCAEHAE3106.1°109.5°
CAJNAKCAQ112.3°119.2°
CAJNAKHAK123.8°120.4°
HAE1CAEHAE2106.1°109.5°
HAE1CAEHAE3106.0°109.4°
HAE2CAEHAE3103.4°109.5°
CAQNAKHAK123.9°120.4°
NAKCAQSAP115.3°102.4°
NAKCAQNAR122.0°128.8°
SAPCAQNAR122.7°128.8°
CAQNARCAS126.8°120.0°
NARCASOAL124.4°120.0°
NARCASCAT115.2°120.0°
OALCASCAT120.4°120.0°
CASCATHAT1115.2°109.5°
CASCATHAT2110.1°109.5°
CASCATHAT3110.1°109.5°
HAT1CATHAT2110.1°109.4°
HAT1CATHAT3110.1°109.5°
HAT2CATHAT3100.2°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
OAMSANOAONAU119.1°123.1°
OAMSANOAOCAF117.9°123.1°
OAMSANNAUCAF121.4°112.6°
OAMSANNAUCAV23.9°177.6°
OAMSANNAUHAU156.1°2.4°
OAMSANCAFCAB176.9°177.6°
OAMSANCAFCAG4.0°2.6°
OAOSANNAUCAF121.0°112.6°
OAOSANNAUCAV141.5°47.6°
OAOSANNAUHAU38.5°132.4°
OAOSANCAFCAB65.7°47.6°
OAOSANCAFCAG113.5°132.2°
SANNAUCAVHAU180.0°180.0°
SANNAUCAVCAW165.0°165.0°
SANNAUCAVHAV139.7°75.0°
SANNAUCAVHAV269.8°45.1°
NAUSANCAFCAB54.5°65.0°
NAUSANCAFCAG126.3°115.2°
CAFSANNAUCAV97.5°65.0°
CAFSANNAUHAU82.5°115.1°
SANCAFCABCAG179.2°179.8°
SANCAFCABCL0.7°0.0°
SANCAFCABCAC179.3°180.0°
SANCAFCAGCAH179.2°179.7°
SANCAFCAGHAG0.8°0.2°
NAUCAVCAWHAV1125.3°120.0°
NAUCAVCAWHAV2125.2°119.9°
NAUCAVHAV1HAV2119.4°120.0°
NAUCAVCAWOAX119.5°65.0°
NAUCAVCAWHAW1115.3°175.0°
NAUCAVCAWHAW25.8°55.0°
HAUNAUCAVCAW15.0°15.0°
HAUNAUCAVHAV1140.3°105.0°
HAUNAUCAVHAV2110.3°134.9°
CAWCAVHAV1HAV2119.4°120.0°
CAVCAWOAXHAW1125.3°120.0°
CAVCAWOAXHAW2125.3°120.1°
CAVCAWHAW1HAW2117.9°120.1°
CAVCAWOAXHAX180.0°180.0°
HAV1CAVCAWOAX5.8°55.0°
HAV1CAVCAWHAW1119.5°65.0°
HAV1CAVCAWHAW2131.0°175.0°
HAV2CAVCAWOAX115.3°175.0°
HAV2CAVCAWHAW110.0°55.1°
HAV2CAVCAWHAW2119.5°64.9°
OAXCAWHAW1HAW2117.9°119.9°
HAW1CAWOAXHAX54.8°60.0°
HAW2CAWOAXHAX54.7°60.0°
CAFCABCLCAC179.9°180.0°
CAFCABCACCAD0.3°0.0°
CAFCABCACHAC179.7°180.0°
CABCAFCAGCAH0.0°0.5°
CABCAFCAGHAG180.0°179.9°
CAGCAFCABCL179.9°179.7°
CAGCAFCABCAC0.1°0.3°
CAFCAGCAHCAD0.0°0.5°
CAFCAGCAHHAG180.0°179.6°
CAFCAGCAHCAI180.0°179.8°
CLCABCACCAD179.8°180.0°
CLCABCACHAC0.2°0.0°
CABCACCADHAC180.0°180.0°
CABCACCADCAH0.3°0.0°
CABCACCADHAD179.7°179.9°
CACCADCAHHAD180.0°179.9°
CACCADCAHCAG0.1°0.2°
CACCADCAHCAI179.9°180.0°
HACCACCADCAH179.7°180.0°
HACCACCADHAD0.3°0.0°
CADCAHCAGCAI180.0°179.7°
CADCAHCAGHAG180.0°180.0°
CADCAHCAICAJ0.4°40.0°
CADCAHCAISAP179.4°139.7°
HADCADCAHCAG179.9°179.8°
HADCADCAHCAI0.1°0.1°
CAGCAHCAICAJ179.6°140.3°
CAGCAHCAISAP0.7°40.0°
HAGCAGCAHCAI0.1°0.2°
CAHCAICAJSAP179.8°179.8°
CAHCAICAJCAE0.4°0.0°
CAHCAICAJNAK180.0°180.0°
CAHCAISAPCAQ180.0°179.9°
CAICAJCAENAK179.5°179.9°
CAICAJCAEHAE1180.0°180.0°
CAICAJCAEHAE254.8°60.1°
CAICAJCAEHAE354.7°60.0°
CAICAJNAKCAQ0.0°0.0°
CAICAJNAKHAK180.0°180.0°
CAJCAISAPCAQ0.2°0.4°
SAPCAICAJCAE179.4°179.8°
SAPCAICAJNAK0.2°0.3°
CAISAPCAQNAK0.2°0.4°
CAISAPCAQNAR178.7°180.0°
CAJCAEHAE1HAE2125.3°120.0°
CAJCAEHAE1HAE3125.3°120.0°
CAJCAEHAE2HAE3111.4°120.1°
CAECAJNAKCAQ179.6°179.9°
CAECAJNAKHAK0.4°0.1°
NAKCAJCAEHAE10.5°0.1°
NAKCAJCAEHAE2124.8°120.0°
NAKCAJCAEHAE3125.7°119.9°
CAJNAKCAQHAK180.0°180.0°
CAJNAKCAQSAP0.1°0.3°
CAJNAKCAQNAR178.8°179.9°
HAE1CAEHAE2HAE3111.4°120.0°
NAKCAQSAPNAR178.9°179.7°
NAKCAQNARCAS144.8°180.0°
HAKNAKCAQSAP179.9°179.7°
HAKNAKCAQNAR1.2°0.0°
SAPCAQNARCAS36.3°0.4°
CAQNARCASOAL1.2°0.1°
CAQNARCASCAT179.5°180.0°
NARCASOALCAT179.3°180.0°
NARCASCATHAT1180.0°180.0°
NARCASCATHAT254.8°60.0°
NARCASCATHAT354.8°60.0°
OALCASCATHAT10.6°0.0°
OALCASCATHAT2124.6°120.0°
OALCASCATHAT3125.9°120.0°
CASCATHAT1HAT2125.2°120.0°
CASCATHAT1HAT3125.2°120.0°
CASCATHAT2HAT3115.9°120.0°
HAT1CATHAT2HAT3115.9°120.0°

222415

PDB entries from 2024-07-10

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