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B8C

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
OAMCALdoub1.22Å1.27Å
OBDCAUsing1.43Å1.39Å
CALNAKsing1.34Å1.37Å
CALNANsing1.34Å1.41Å
NAKCAJdoub1.31Å1.37Å
NANCAOsing1.33Å1.40Å
OBECATsing1.43Å1.37Å
CAUCATsing1.53Å1.49Å
CAUCAVsing1.53Å1.42Å
CATCASsing1.53Å1.46Å
CAWOAXsing1.43Å1.40Å
CAWCAVsing1.53Å1.46Å
OAXPAYsing1.61Å1.72Å
CAVOBCsing1.43Å1.43Å
CASNAIsing1.46Å1.52Å
CAJNAIsing1.35Å1.36Å
CAJCAQsing1.51Å1.44Å
CAOCAQsing1.50Å1.34Å
CAOOAPdoub1.21Å1.28Å
NAICAEsing1.40Å1.41Å
OBFCAQsing1.43Å1.66Å
OBFCBHsing1.36Å1.47Å
CAQNARsing1.47Å1.46Å
OBAPAYdoub1.48Å1.55Å
OBMCBJdoub1.21Å1.22Å
PAYOAZsing1.61Å1.44Å
PAYOBBsing1.61Å1.55Å
CBHCBIdoub1.36Å1.43Å
CBHCBGsing1.47Å1.54Å
CAECAFdoub1.39Å1.36ÅAromatic
CAECADsing1.40Å1.41ÅAromatic
CBJOBNsing1.35Å1.22Å
CBJCBIsing1.47Å1.45Å
NARCADsing1.41Å1.32Å
OBLCBGdoub1.22Å1.23Å
CBIOBOsing1.36Å1.35Å
CBGOBKsing1.35Å1.29Å
CAFCAGsing1.38Å1.40ÅAromatic
CADCACdoub1.38Å1.36ÅAromatic
CAGCAHsing1.51Å1.40Å
CAGCABdoub1.38Å1.34ÅAromatic
CACCABsing1.38Å1.42ÅAromatic
CABCAAsing1.51Å1.41Å
OAZH1sing0.97Å0.95Å
OBBH2sing0.97Å0.95Å
CAWH3sing1.09Å1.10Å
CAWH4sing1.09Å1.10Å
CAVH5sing1.09Å1.10Å
OBCH6sing0.97Å0.95Å
CAUH7sing1.09Å1.10Å
OBDH8sing0.97Å0.95Å
CATH9sing1.09Å1.10Å
OBEH10sing0.97Å0.95Å
CASH11sing1.09Å1.10Å
CASH12sing1.09Å1.10Å
CAFH13sing1.08Å1.08Å
CAHH14sing1.09Å1.10Å
CAHH15sing1.09Å1.10Å
CAHH16sing1.09Å1.10Å
CAAH17sing1.09Å1.10Å
CAAH18sing1.09Å1.10Å
CAAH19sing1.09Å1.10Å
CACH20sing1.08Å1.08Å
NARH21sing0.97Å1.00Å
OBKH22sing0.97Å0.95Å
OBNH23sing0.97Å0.95Å
OBOH24sing0.97Å0.95Å
NANH25sing0.97Å1.00Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
OAMCALNAK129.1°119.0°
OAMCALNAN116.8°119.0°
OBDCAUCAT115.7°109.5°
OBDCAUCAV119.1°109.5°
OBDCAUH796.5°109.4°
CAUOBDH8109.5°114.0°
NAKCALNAN114.0°121.9°
CALNAKCAJ118.9°122.3°
CALNANCAO126.4°120.3°
CALNANH25116.8°119.6°
NAKCAJNAI122.1°120.1°
NAKCAJCAQ123.3°120.8°
NANCAOCAQ114.5°121.6°
NANCAOOAP119.8°119.7°
CAONANH25116.8°120.1°
OBECATCAU111.4°109.4°
OBECATCAS125.0°109.5°
OBECATH9103.7°109.5°
CATOBEH10109.5°114.0°
CATCAUCAV121.7°109.5°
CAUCATCAS108.5°109.5°
CATCAUH796.0°109.5°
CAUCATH9102.5°109.4°
CAUCAVCAW116.4°109.5°
CAUCAVOBC117.1°109.4°
CAUCAVH5108.4°109.5°
CAVCAUH796.3°109.5°
CATCASNAI107.8°109.5°
CASCATH9102.8°109.5°
CATCASH11109.9°109.5°
CATCASH12109.9°109.5°
OAXCAWCAV99.6°109.5°
CAWOAXPAY133.4°123.0°
OAXCAWH3111.9°109.5°
OAXCAWH4111.9°109.5°
CAWCAVOBC98.1°109.4°
CAVCAWH3111.9°109.5°
CAVCAWH4111.9°109.5°
CAWCAVH5107.9°109.5°
OAXPAYOBA102.8°109.4°
OAXPAYOAZ110.9°109.5°
OAXPAYOBB113.2°109.4°
OBCCAVH5108.3°109.5°
CAVOBCH6109.5°114.1°
CASNAICAJ119.3°120.0°
CASNAICAE116.9°120.0°
NAICASH11109.9°109.5°
NAICASH12109.9°109.4°
NAICAJCAQ114.0°119.1°
CAJNAICAE123.8°120.0°
CAJCAQCAO113.0°110.1°
CAJCAQOBF110.6°108.8°
CAJCAQNAR120.0°108.6°
CAQCAOOAP120.6°118.7°
CAOCAQOBF101.0°108.7°
CAOCAQNAR114.5°111.9°
NAICAECAF123.1°120.4°
NAICAECAD121.4°120.1°
CAQOBFCBH122.4°117.0°
OBFCAQNAR94.0°108.6°
OBFCBHCBI120.7°120.0°
OBFCBHCBG132.0°120.0°
CAQNARCAD122.0°116.4°
CAQNARH21106.2°121.8°
OBAPAYOAZ107.6°109.5°
OBAPAYOBB105.3°109.5°
OBMCBJOBN120.7°120.0°
OBMCBJCBI117.2°120.0°
OAZPAYOBB116.0°109.4°
PAYOAZH1109.5°114.0°
PAYOBBH2109.5°114.0°
CBICBHCBG106.3°120.0°
CBHCBICBJ115.3°120.0°
CBHCBIOBO119.2°120.0°
CBHCBGOBL119.2°120.0°
CBHCBGOBK121.7°120.0°
CAFCAECAD115.5°119.5°
CAECAFCAG123.5°119.9°
CAECAFH13118.3°120.1°
CAECADNAR116.6°118.8°
CAECADCAC123.2°120.3°
OBNCBJCBI122.1°120.0°
CBJOBNH23109.5°117.0°
CBJCBIOBO125.5°120.0°
NARCADCAC120.1°120.9°
CADNARH21106.3°121.8°
OBLCBGOBK119.0°120.0°
CBIOBOH24109.5°114.0°
CBGOBKH22109.5°117.0°
CAFCAGCAH117.1°119.8°
CAFCAGCAB119.2°120.4°
CAGCAFH13118.2°120.0°
CADCACCAB117.9°119.7°
CADCACH20121.1°120.1°
CAHCAGCAB123.6°119.7°
CAGCAHH14109.5°109.5°
CAGCAHH15109.5°109.5°
CAGCAHH16109.5°109.5°
CAGCABCAC120.6°120.1°
CAGCABCAA119.2°120.0°
CACCABCAA120.2°119.9°
CABCACH20121.0°120.1°
CABCAAH17109.5°109.5°
CABCAAH18109.5°109.5°
CABCAAH19109.5°109.5°
H3CAWH4109.4°109.4°
H11CASH12109.5°109.4°
H14CAHH15109.5°109.5°
H14CAHH16109.5°109.5°
H15CAHH16109.4°109.4°
H17CAAH18109.4°109.5°
H17CAAH19109.5°109.5°
H18CAAH19109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
OAMCALNAKNAN174.8°180.0°
OAMCALNAKCAJ178.6°172.5°
OAMCALNANCAO174.9°170.7°
OAMCALNANH255.1°9.6°
OBDCAUCATOBE69.5°179.9°
OBDCAUCATCAV158.6°120.1°
OBDCAUCATH7100.2°120.0°
OBDCAUCAVH7101.0°120.0°
OBDCAUCATCAS71.9°60.0°
OBDCAUCAVCAW17.0°55.0°
OBDCAUCAVOBC132.5°65.0°
OBDCAUCAVH5104.8°175.0°
OBDCAUCATH9179.8°60.0°
NAKCALNANCAO0.5°9.3°
CALNAKCAJNAI176.8°172.4°
CALNAKCAJCAQ12.9°7.3°
NAKCALNANH25179.5°170.4°
NANCALNAKCAJ3.8°7.5°
CALNANCAOH25180.0°179.7°
CALNANCAOCAQ21.6°3.7°
CALNANCAOOAP176.5°177.1°
NAKCAJNAICAS1.1°12.2°
NAKCAJNAICAQ171.2°179.6°
NAKCAJCAQCAO33.7°17.7°
NAKCAJNAICAE178.2°167.5°
NAKCAJCAQOBF78.7°101.4°
NAKCAJCAQNAR173.7°140.5°
NANCAOCAQCAJ34.9°15.9°
NANCAOCAQOAP154.6°179.2°
NANCAOCAQOBF83.2°103.2°
NANCAOCAQNAR177.2°136.8°
OBECATCAUCAS141.5°120.0°
OBECATCAUH9110.3°120.0°
OBECATCAUCAV131.9°60.0°
OBECATCASH9117.1°120.1°
OBECATCASNAI54.0°65.5°
OBECATCAUH730.7°60.0°
OBECATCASH1165.7°54.5°
OBECATCASH12173.8°174.5°
CATCAUCAVH7101.1°120.0°
CAUCATCASH9108.1°119.9°
CATCAUCAVCAW140.9°175.0°
CATCAUCAVOBC25.4°55.1°
CAUCATCASNAI171.1°174.5°
CATCAUCAVH597.3°65.0°
CATCAUOBDH8180.0°60.0°
CAUCATOBEH10180.0°64.7°
CAUCATCASH1169.2°65.4°
CAUCATCASH1251.4°54.6°
CAVCAUCATCAS86.6°180.0°
CAUCAVCAWOAX139.0°175.0°
CAUCAVCAWOBC125.7°119.9°
CAUCAVCAWH5122.0°120.0°
CAUCAVOBCH5122.8°120.0°
CAUCAVCAWH320.6°55.0°
CAUCAVCAWH4102.6°64.9°
CAUCAVOBCH6180.0°59.9°
CAVCAUOBDH820.8°60.0°
CAVCAUCATH921.6°60.0°
CATCASNAIH11119.7°120.1°
CATCASNAIH12119.7°120.0°
CATCASNAICAJ81.1°95.7°
CATCASNAICAE98.3°83.9°
CASCATCAUH7172.1°60.0°
CASCATOBEH1046.2°55.2°
CATCASH11H12120.8°120.0°
OAXCAWCAVH3118.4°120.0°
OAXCAWCAVH4118.4°120.0°
OAXCAWCAVOBC95.3°65.0°
CAWOAXPAYOBA147.8°55.1°
CAWOAXPAYOAZ97.6°65.0°
CAWOAXPAYOBB34.7°175.0°
OAXCAWH3H4124.6°120.0°
OAXCAWCAVH516.9°55.0°
CAVCAWOAXPAY82.2°180.0°
CAWCAVOBCH5112.0°120.0°
CAVCAWH3H4124.6°120.0°
CAWCAVOBCH654.8°60.0°
CAWCAVCAUH7118.1°65.0°
OAXPAYOBAOAZ117.0°120.0°
OAXPAYOBAOBB118.7°120.0°
OAXPAYOAZOBB130.8°120.0°
OAXPAYOAZH1111.6°60.0°
OAXPAYOBBH2111.5°180.0°
PAYOAXCAWH3159.4°60.0°
PAYOAXCAWH436.2°60.0°
OBCCAVCAWH3146.3°174.9°
OBCCAVCAWH423.1°55.0°
OBCCAVCAUH7126.5°175.1°
CASNAICAJCAE179.3°179.7°
CASNAICAJCAQ170.0°168.2°
CASNAICAECAF6.4°10.4°
CASNAICAECAD174.2°169.4°
NAICASCATH963.0°54.6°
NAICASH11H12120.8°119.9°
NAICAJCAQCAO155.3°162.0°
NAICAJCAQOBF92.3°79.0°
NAICAJCAQNAR15.3°39.2°
CAJNAICAECAF172.9°170.0°
CAJNAICAECAD6.5°10.3°
CAJNAICASH1138.6°24.3°
CAJNAICASH12159.2°144.3°
CAJCAQCAOOBF118.1°119.1°
CAJCAQCAONAR142.3°120.9°
CAJCAQCAOOAP170.5°164.9°
CAQCAJNAICAE10.6°12.2°
CAJCAQOBFNAR124.2°118.1°
CAJCAQOBFCBH143.2°175.8°
CAJCAQNARCAD17.0°46.5°
CAJCAQNARH21104.7°133.6°
CAOCAQOBFNAR116.0°122.0°
CAOCAQOBFCBH97.0°55.9°
CAOCAQNARCAD156.4°168.2°
CAOCAQNARH2134.7°11.9°
CAQCAONANH25158.3°176.6°
OAPCAOCAQOBF71.3°76.0°
OAPCAOCAQNAR28.3°44.0°
OAPCAONANH253.5°2.6°
NAICAECAFCAD179.4°179.7°
NAICAECADNAR6.5°2.2°
NAICAECAFCAG178.4°179.2°
NAICAECADCAC178.1°178.9°
CAENAICASH11142.0°156.0°
CAENAICASH1221.4°36.0°
NAICAECAFH131.6°0.8°
CAQOBFCBHCBI105.3°97.6°
CAQOBFCBHCBG61.6°82.4°
OBFCAQNARCAD99.5°71.8°
OBFCAQNARH21138.8°108.2°
CBHOBFCAQNAR19.0°66.1°
OBFCBHCBICBG169.9°180.0°
OBFCBHCBICBJ9.3°7.9°
OBFCBHCBGOBL8.7°0.1°
OBFCBHCBIOBO170.2°172.1°
OBFCBHCBGOBK174.8°180.0°
CAQNARCADCAE11.8°28.1°
CAQNARCADH21121.7°179.9°
CAQNARCADCAC172.7°150.7°
OBAPAYOAZOBB117.6°120.0°
OBAPAYOAZH10.0°180.0°
OBAPAYOBBH20.0°60.0°
OBMCBJCBICBH5.0°6.3°
OBMCBJOBNCBI178.7°180.0°
OBMCBJCBIOBO174.5°173.7°
OBMCBJOBNH230.0°0.0°
OAZPAYOBBH2118.8°60.1°
OBBPAYOAZH1117.5°60.0°
CBHCBICBJOBN176.2°173.7°
CBHCBICBJOBO179.5°180.0°
CBICBHCBGOBL177.0°180.0°
CBICBHCBGOBK6.5°0.1°
CBHCBIOBOH24180.0°180.0°
CBGCBHCBICBJ179.2°172.0°
CBHCBGOBLOBK176.6°179.9°
CBGCBHCBIOBO0.3°8.0°
CBHCBGOBKH22176.5°180.0°
CAFCAECADNAR173.0°178.0°
CAECAFCAGH13180.0°179.9°
CAFCAECADCAC2.4°0.9°
CAECAFCAGCAH177.4°179.9°
CAECAFCAGCAB0.7°0.1°
CAECADNARCAC175.6°178.9°
CADCAECAFCAG2.1°0.5°
CAECADCACCAB0.0°0.6°
CADCAECAFH13177.9°179.4°
CAECADCACH20180.0°179.3°
CAECADNARH21109.9°151.9°
OBNCBJCBIOBO4.3°6.3°
CBICBJOBNH23178.7°180.0°
CBJCBIOBOH240.6°0.0°
NARCADCACCAB175.2°178.3°
NARCADCACH204.8°1.8°
OBLCBGOBKH220.0°0.1°
CAFCAGCAHCAB176.5°180.0°
CAFCAGCABCAC3.3°0.3°
CAFCAGCABCAA179.9°179.7°
CAFCAGCAHH1491.5°90.0°
CAFCAGCAHH15148.5°150.0°
CAFCAGCAHH1628.5°30.0°
CADCACCABCAG2.9°0.0°
CADCACCABH20180.0°179.9°
CADCACCABCAA179.7°180.0°
CACCADNARH2165.6°29.2°
CAHCAGCABCAC179.7°179.7°
CAHCAGCABCAA3.5°0.3°
CAHCAGCAFH132.6°0.0°
CAGCAHH14H15120.0°120.1°
CAGCAHH14H16120.0°120.0°
CAGCAHH15H16120.0°120.0°
CAGCABCACCAA176.8°180.0°
CABCAGCAFH13179.3°180.0°
CABCAGCAHH1492.0°90.0°
CABCAGCAHH1528.1°30.1°
CABCAGCAHH16148.0°150.0°
CAGCABCAAH1788.5°90.0°
CAGCABCAAH18151.6°150.0°
CAGCABCAAH1931.5°30.0°
CAGCABCACH20177.1°179.9°
CACCABCAAH1788.4°90.0°
CACCABCAAH1831.6°30.0°
CACCABCAAH19151.7°150.0°
CABCAAH17H18120.0°120.0°
CABCAAH17H19120.0°120.0°
CABCAAH18H19120.0°120.0°
CAACABCACH200.3°0.1°
H3CAWCAVH5101.4°65.0°
H4CAWCAVH5135.3°175.0°
H5CAVOBCH657.2°179.9°
H5CAVCAUH73.8°55.0°
H7CAUOBDH880.1°180.0°
H7CAUCATH979.6°180.0°
H9CATOBEH1070.4°175.3°
H9CATCASH11177.2°174.6°
H9CATCASH1256.7°65.4°
H14CAHH15H16120.0°120.0°
H17CAAH18H19120.0°120.0°

222624

PDB entries from 2024-07-17

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