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CDX

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
OAOCAPdoub1.21Å1.21Å
CAPNAIsing1.35Å1.35Å
CAPCAQsing1.51Å1.50Å
NAICACsing1.35Å1.34Å
NAIHAIsing0.97Å1.02Å
CACOABdoub1.21Å1.21Å
CACCADsing1.51Å1.52Å
CADNAJsing1.47Å1.46Å
CADHAD1sing1.09Å1.12Å
CADHAD2sing1.09Å1.12Å
CAQNAJsing1.47Å1.46Å
CAQHAQ1sing1.09Å1.11Å
CAQHAQ2sing1.09Å1.12Å
NAJCAKsing1.47Å1.45Å
CAKCALsing1.53Å1.53Å
CAKHAK1sing1.09Å1.12Å
CAKHAK2sing1.09Å1.12Å
CALCAEsing1.53Å1.53Å
CALNAMsing1.47Å1.47Å
CALHALsing1.09Å1.11Å
CAEHAE1sing1.09Å1.11Å
CAEHAE2sing1.09Å1.11Å
CAEHAE3sing1.09Å1.12Å
NAMCARsing1.47Å1.47Å
NAMCAFsing1.47Å1.46Å
CARCASsing1.51Å1.52Å
CARHAR1sing1.09Å1.11Å
CARHAR2sing1.09Å1.12Å
CASOATdoub1.21Å1.22Å
CASNANsing1.35Å1.35Å
NANCAGsing1.35Å1.35Å
NANHANsing0.97Å1.02Å
CAGCAFsing1.51Å1.50Å
CAGOAHdoub1.21Å1.22Å
CAFHAF1sing1.09Å1.12Å
CAFHAF2sing1.09Å1.12Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
OAOCAPNAI124.2°119.9°
OAOCAPCAQ118.5°119.9°
NAICAPCAQ117.3°120.2°
CAPNAICAC123.8°120.3°
CAPNAIHAI118.2°119.8°
CAPCAQNAJ105.6°109.6°
CAPCAQHAQ1113.7°109.4°
CAPCAQHAQ2113.7°109.5°
CACNAIHAI117.9°119.8°
NAICACOAB122.1°119.9°
NAICACCAD118.0°120.3°
OABCACCAD119.9°119.8°
CACCADNAJ104.7°109.6°
CACCADHAD1114.0°109.5°
CACCADHAD2114.1°109.4°
NAJCADHAD1114.0°109.4°
NAJCADHAD2114.0°109.5°
CADNAJCAQ107.1°106.7°
CADNAJCAK114.9°106.7°
HAD1CADHAD296.4°109.5°
NAJCAQHAQ1113.6°109.5°
NAJCAQHAQ2113.6°109.4°
CAQNAJCAK108.9°106.7°
HAQ1CAQHAQ296.8°109.4°
NAJCAKCAL106.9°109.4°
NAJCAKHAK1113.2°109.4°
NAJCAKHAK2113.2°109.5°
CALCAKHAK1113.2°109.5°
CALCAKHAK2113.2°109.5°
CAKCALCAE113.8°109.5°
CAKCALNAM111.0°109.5°
CAKCALHAL105.5°109.4°
HAK1CAKHAK297.2°109.5°
CAECALNAM110.1°109.5°
CAECALHAL106.7°109.4°
CALCAEHAE1113.7°109.4°
CALCAEHAE2110.6°109.5°
CALCAEHAE3110.6°109.5°
NAMCALHAL109.6°109.5°
CALNAMCAR117.2°106.7°
CALNAMCAF113.6°106.7°
HAE1CAEHAE2110.7°109.4°
HAE1CAEHAE3110.6°109.5°
HAE2CAEHAE399.7°109.5°
CARNAMCAF106.5°106.7°
NAMCARCAS102.0°109.6°
NAMCARHAR1115.1°109.5°
NAMCARHAR2115.1°109.4°
NAMCAFCAG102.7°109.6°
NAMCAFHAF1114.8°109.5°
NAMCAFHAF2114.8°109.5°
CASCARHAR1115.1°109.5°
CASCARHAR2115.0°109.4°
CARCASOAT119.9°119.9°
CARCASNAN117.1°120.2°
HAR1CARHAR295.4°109.4°
OATCASNAN122.9°119.9°
CASNANCAG124.2°120.4°
CASNANHAN118.1°119.8°
CAGNANHAN117.7°119.8°
NANCAGCAF116.8°120.2°
NANCAGOAH124.0°119.9°
CAFCAGOAH119.1°119.9°
CAGCAFHAF1114.8°109.5°
CAGCAFHAF2114.7°109.4°
HAF1CAFHAF295.6°109.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
OAOCAPNAICAQ179.0°180.0°
OAOCAPNAICAC179.8°179.7°
OAOCAPNAIHAI0.2°0.3°
OAOCAPCAQNAJ144.8°148.8°
OAOCAPCAQHAQ119.6°91.1°
OAOCAPCAQHAQ289.9°28.8°
CAPNAICACHAI180.0°180.0°
CAPNAICACOAB179.8°179.7°
CAPNAICACCAD1.7°0.3°
NAICAPCAQNAJ34.2°31.2°
NAICAPCAQHAQ1159.5°88.9°
NAICAPCAQHAQ291.0°151.1°
CAQCAPNAICAC0.8°0.3°
CAQCAPNAIHAI179.2°179.7°
CAPCAQNAJCAD70.2°60.6°
CAPCAQNAJHAQ1125.3°120.0°
CAPCAQNAJHAQ2125.3°120.0°
CAPCAQHAQ1HAQ2119.7°120.0°
CAPCAQNAJCAK165.0°174.4°
NAICACOABCAD178.6°180.0°
NAICACCADNAJ32.2°31.2°
NAICACCADHAD193.1°151.2°
NAICACCADHAD2157.5°88.9°
HAINAICACOAB0.2°0.3°
HAINAICACCAD178.3°179.7°
OABCACCADNAJ146.4°148.8°
OABCACCADHAD188.3°28.9°
OABCACCADHAD221.1°91.1°
CACCADNAJHAD1125.3°120.0°
CACCADNAJHAD2125.3°120.0°
CACCADHAD1HAD2120.0°120.0°
CACCADNAJCAQ68.6°60.6°
CACCADNAJCAK170.3°174.4°
NAJCADHAD1HAD2119.9°120.0°
CADNAJCAQCAK124.8°113.8°
CADNAJCAQHAQ1164.5°59.4°
CADNAJCAQHAQ255.1°179.4°
CADNAJCAKCAL150.4°180.0°
CADNAJCAKHAK184.3°60.0°
CADNAJCAKHAK225.2°60.0°
HAD1CADNAJCAQ56.7°179.4°
HAD1CADNAJCAK64.4°65.6°
HAD2CADNAJCAQ166.1°59.4°
HAD2CADNAJCAK45.0°54.4°
NAJCAQHAQ1HAQ2119.5°119.9°
CAQNAJCAKCAL89.5°66.2°
CAQNAJCAKHAK135.8°173.9°
CAQNAJCAKHAK2145.3°53.8°
HAQ1CAQNAJCAK39.7°54.3°
HAQ2CAQNAJCAK69.7°65.6°
NAJCAKCALHAK1125.3°119.9°
NAJCAKCALHAK2125.3°120.0°
NAJCAKHAK1HAK2119.1°120.0°
NAJCAKCALCAE58.9°180.0°
NAJCAKCALNAM176.3°60.0°
NAJCAKCALHAL57.7°60.1°
CALCAKHAK1HAK2119.1°120.1°
CAKCALCAENAM125.3°120.1°
CAKCALCAEHAL115.9°119.9°
CAKCALNAMHAL116.2°120.0°
CAKCALCAEHAE1180.0°52.5°
CAKCALCAEHAE254.7°172.4°
CAKCALCAEHAE354.7°67.5°
CAKCALNAMCAR103.5°75.2°
CAKCALNAMCAF21.4°171.0°
HAK1CAKCALCAE66.4°60.1°
HAK1CAKCALNAM58.4°60.0°
HAK1CAKCALHAL177.0°180.0°
HAK2CAKCALCAE175.8°60.0°
HAK2CAKCALNAM51.0°180.0°
HAK2CAKCALHAL67.6°59.9°
CAECALNAMHAL117.0°120.0°
CALCAEHAE1HAE2125.2°120.0°
CALCAEHAE1HAE3125.2°120.0°
CALCAEHAE2HAE3116.5°120.1°
CAECALNAMCAR23.4°44.8°
CAECALNAMCAF148.2°69.0°
NAMCALCAEHAE154.7°67.6°
NAMCALCAEHAE2180.0°52.4°
NAMCALCAEHAE370.6°172.4°
CALNAMCARCAF128.3°113.8°
CALNAMCARCAS157.6°174.4°
CALNAMCARHAR132.3°54.3°
CALNAMCARHAR277.2°65.6°
CALNAMCAFCAG154.7°174.3°
CALNAMCAFHAF180.0°65.5°
CALNAMCAFHAF229.4°54.4°
HALCALCAEHAE164.1°172.4°
HALCALCAEHAE261.2°67.6°
HALCALCAEHAE3170.7°52.4°
HALCALNAMCAR140.4°164.8°
HALCALNAMCAF94.8°51.0°
HAE1CAEHAE2HAE3116.5°120.0°
NAMCARCASHAR1125.3°120.2°
NAMCARCASHAR2125.2°120.0°
NAMCARHAR1HAR2120.9°119.8°
NAMCARCASOAT144.2°148.8°
NAMCARCASNAN34.1°31.2°
CARNAMCAFCAG74.9°60.5°
CARNAMCAFHAF150.3°179.4°
CARNAMCAFHAF2159.8°59.4°
CAFNAMCARCAS74.1°60.6°
CAFNAMCARHAR1160.6°59.5°
CAFNAMCARHAR251.1°179.4°
NAMCAFCAGNAN34.9°31.1°
NAMCAFCAGHAF1125.3°120.1°
NAMCAFCAGHAF2125.3°120.0°
NAMCAFCAGOAH144.0°148.8°
NAMCAFHAF1HAF2120.7°120.0°
CASCARHAR1HAR2120.9°119.9°
CARCASOATNAN178.2°180.0°
CARCASNANCAG1.7°0.3°
CARCASNANHAN178.3°179.8°
HAR1CARCASOAT18.9°91.0°
HAR1CARCASNAN159.4°89.0°
HAR2CARCASOAT90.6°28.9°
HAR2CARCASNAN91.1°151.2°
OATCASNANCAG179.9°179.7°
OATCASNANHAN0.1°0.3°
CASNANCAGHAN180.0°180.0°
CASNANCAGCAF1.5°0.3°
CASNANCAGOAH179.7°179.7°
NANCAGCAFOAH178.8°179.9°
NANCAGCAFHAF190.4°151.2°
NANCAGCAFHAF2160.2°88.9°
HANNANCAGCAF178.5°179.7°
HANNANCAGOAH0.2°0.2°
CAGCAFHAF1HAF2120.6°119.9°
OAHCAGCAFHAF190.7°28.7°
OAHCAGCAFHAF218.7°91.2°

222415

PDB entries from 2024-07-10

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