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69B

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
CAXNATsing1.47Å1.48Å
CAYCAZsing1.53Å1.52Å
CAYCAWsing1.53Å1.52Å
NAUNATsing1.40Å1.30ÅAromatic
NAUCAVdoub1.30Å1.33ÅAromatic
NATCAQsing1.37Å1.35ÅAromatic
CAZCAWsing1.53Å1.52Å
CAVCAWsing1.51Å1.54Å
CAVCARsing1.46Å1.36ÅAromatic
CAQCAPdoub1.39Å1.36ÅAromatic
CAQCARsing1.41Å1.35ÅAromatic
CAPCAOsing1.36Å1.40ÅAromatic
CARCASdoub1.40Å1.36ÅAromatic
CAICADsing1.53Å1.52Å
CAOCANdoub1.40Å1.40ÅAromatic
CASCANsing1.39Å1.42ÅAromatic
CADNAEsing1.47Å1.48Å
CADCACsing1.53Å1.55Å
CANCAJsing1.48Å1.43Å
NAECAFsing1.39Å1.41Å
CAJCAFdoub1.40Å1.41ÅAromatic
CAJCAKsing1.39Å1.40ÅAromatic
CAFCAGsing1.39Å1.39ÅAromatic
CACCABsing1.51Å1.43Å
OAHCABdoub1.21Å1.24Å
CABNAAsing1.35Å1.38Å
CAKCALdoub1.38Å1.39ÅAromatic
CAGNAAsing1.40Å1.40Å
CAGCAMdoub1.38Å1.40ÅAromatic
CALCAMsing1.38Å1.39ÅAromatic
CAYH1sing1.09Å1.10Å
CAYH2sing1.09Å1.10Å
CAZH3sing1.09Å1.10Å
CAZH4sing1.09Å1.10Å
CAWH5sing1.09Å1.10Å
CASH6sing1.08Å1.08Å
CAXH7sing1.09Å1.10Å
CAXH8sing1.09Å1.10Å
CAXH9sing1.09Å1.10Å
CAPH10sing1.08Å1.08Å
CAOH11sing1.08Å1.08Å
NAEH12sing1.01Å1.00Å
CADH13sing1.09Å1.10Å
CAIH14sing1.09Å1.10Å
CAIH15sing1.09Å1.10Å
CAIH16sing1.09Å1.10Å
CACH17sing1.09Å1.10Å
CACH18sing1.09Å1.10Å
NAAH19sing0.97Å1.00Å
CAMH20sing1.08Å1.08Å
CALH21sing1.08Å1.08Å
CAKH22sing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
CAXNATNAU121.7°125.4°
CAXNATCAQ127.2°125.5°
NATCAXH7109.5°109.5°
NATCAXH8109.5°109.4°
NATCAXH9109.5°109.5°
CAZCAYCAW60.2°60.0°
CAYCAZCAW60.1°60.0°
CAZCAYH1120.0°117.4°
CAZCAYH2120.0°117.5°
CAYCAZH3120.0°117.5°
CAYCAZH4120.0°117.5°
CAYCAWCAZ59.7°60.0°
CAYCAWCAV117.4°117.5°
CAWCAYH1120.0°117.5°
CAWCAYH2119.9°117.5°
CAYCAWH5116.1°117.5°
NATNAUCAV106.5°110.1°
NAUNATCAQ110.5°109.1°
NAUCAVCAW121.2°126.1°
NAUCAVCAR110.6°107.8°
NATCAQCAP131.4°133.6°
NATCAQCAR107.0°106.7°
CAZCAWCAV120.1°117.5°
CAWCAZH3120.0°117.5°
CAWCAZH4120.0°117.6°
CAZCAWH5116.0°117.5°
CAWCAVCAR127.9°126.1°
CAVCAWH5115.8°115.5°
CAVCARCAQ105.2°106.3°
CAVCARCAS134.3°133.9°
CAPCAQCAR121.5°119.7°
CAQCAPCAO119.6°120.2°
CAQCAPH10120.2°119.9°
CAQCARCAS120.4°119.8°
CAPCAOCAN120.3°120.6°
CAOCAPH10120.2°119.9°
CAPCAOH11119.8°119.6°
CARCASCAN121.1°119.4°
CARCASH6119.5°120.3°
CAICADNAE109.3°109.3°
CAICADCAC111.0°109.3°
CAICADH13108.4°109.2°
CADCAIH14109.5°109.5°
CADCAIH15109.5°109.5°
CADCAIH16109.5°109.5°
CAOCANCAS116.8°120.2°
CAOCANCAJ122.4°119.9°
CANCAOH11119.8°119.7°
CASCANCAJ120.7°119.9°
CANCASH6119.4°120.3°
NAECADCAC111.1°110.4°
CADNAECAF122.4°112.5°
CADNAEH12106.1°111.1°
NAECADH13109.0°109.3°
CADCACCAB111.4°110.4°
CACCADH13108.0°109.3°
CADCACH17109.0°109.3°
CADCACH18109.0°109.3°
CANCAJCAF123.4°120.2°
CANCAJCAK119.0°120.1°
NAECAFCAJ118.4°120.4°
NAECAFCAG121.1°119.9°
CAFNAEH12106.2°111.0°
CAFCAJCAK117.5°119.6°
CAJCAFCAG120.2°119.7°
CAJCAKCAL122.3°120.2°
CAJCAKH22118.8°119.9°
CAFCAGNAA121.4°119.4°
CAFCAGCAM121.3°120.1°
CACCABOAH122.7°120.3°
CACCABNAA118.6°119.5°
CABCACH17109.0°109.3°
CABCACH18109.0°109.4°
OAHCABNAA118.7°120.3°
CABNAACAG123.6°118.5°
CABNAAH19118.2°120.8°
CAKCALCAM119.3°120.3°
CAKCALH21120.3°119.9°
CALCAKH22118.8°119.9°
NAACAGCAM116.8°120.5°
CAGNAAH19118.2°120.7°
CAGCAMCAL119.3°120.2°
CAGCAMH20120.3°119.9°
CALCAMH20120.4°119.9°
CAMCALH21120.4°119.8°
H1CAYH2109.5°115.6°
H3CAZH4109.4°115.5°
H7CAXH8109.5°109.5°
H7CAXH9109.5°109.5°
H8CAXH9109.5°109.4°
H14CAIH15109.4°109.5°
H14CAIH16109.5°109.4°
H15CAIH16109.5°109.5°
H17CACH18109.4°109.2°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
CAXNATNAUCAQ171.8°179.9°
CAXNATNAUCAV176.0°179.9°
CAXNATCAQCAP8.2°0.0°
CAXNATCAQCAR173.9°179.9°
NATCAXH7H8120.0°120.0°
NATCAXH7H9120.0°120.0°
NATCAXH8H9120.0°119.9°
CAZCAYCAWH1109.5°107.4°
CAZCAYCAWH2109.5°107.5°
CAYCAZCAWH3109.5°107.4°
CAYCAZCAWH4109.5°107.5°
CAYCAZCAWCAV106.1°107.5°
CAZCAYH1H2144.6°145.6°
CAYCAZH3H4144.7°145.6°
CAZCAYCAWH5106.3°107.5°
CAYCAWCAVNAU41.4°60.3°
CAYCAWCAVH5143.2°145.7°
CAYCAWCAVCAR146.3°120.0°
CAWCAYH1H2144.6°145.8°
NATNAUCAVCAW177.8°180.0°
NATNAUCAVCAR4.3°0.3°
NAUNATCAQCAP179.4°180.0°
NAUNATCAQCAR2.7°0.1°
NAUNATCAXH70.0°89.9°
NAUNATCAXH8120.0°150.0°
NAUNATCAXH9120.0°30.1°
CAVNAUNATCAQ4.3°0.1°
NAUCAVCAWCAZ110.5°8.3°
NAUCAVCAWCAR172.3°179.7°
NAUCAVCARCAQ2.6°0.3°
NAUCAVCARCAS175.1°179.8°
NAUCAVCAWH5101.8°154.0°
NATCAQCARCAV0.1°0.2°
NATCAQCAPCAR177.6°179.9°
NATCAQCAPCAO177.6°179.9°
NATCAQCARCAS178.2°179.8°
CAQNATCAXH7170.3°90.1°
CAQNATCAXH850.3°29.9°
CAQNATCAXH969.7°149.8°
NATCAQCAPH102.4°0.1°
CAZCAWCAVH5147.6°145.7°
CAZCAWCAVCAR77.2°171.4°
CAWCAZH3H4144.7°145.8°
CAWCAVCARCAQ175.5°180.0°
CAWCAVCARCAS2.2°0.1°
CAVCAWCAYH11.1°0.1°
CAVCAWCAYH2139.9°145.0°
CAVCAWCAZH3144.4°145.0°
CAVCAWCAZH43.4°0.0°
CAVCARCAQCAP178.2°179.9°
CAVCARCAQCAS178.1°179.9°
CAVCARCASCAN179.0°179.9°
CARCAVCAWH570.5°25.7°
CAVCARCASH60.9°0.1°
CAQCAPCAOH10180.0°179.9°
CAPCAQCARCAS3.7°0.1°
CAQCAPCAOCAN3.9°0.2°
CAQCAPCAOH11176.1°180.0°
CARCAQCAPCAO0.0°0.0°
CAQCARCASCAN3.5°0.1°
CAQCARCASH6176.5°180.0°
CARCAQCAPH10180.0°179.9°
CAPCAOCANH11180.0°179.8°
CAPCAOCANCAS3.9°0.3°
CAPCAOCANCAJ173.8°179.9°
CARCASCANCAO0.3°0.2°
CARCASCANH6180.0°180.0°
CARCASCANCAJ177.5°180.0°
CAICADNAECAC122.9°120.3°
CAICADNAEH13118.3°119.5°
CAICADCACH13118.7°119.4°
CAICADNAECAF157.9°76.1°
CAICADCACCAB73.9°164.1°
CAICADNAEH1280.3°158.8°
CADCAIH14H15120.0°120.0°
CADCAIH14H16120.0°120.0°
CADCAIH15H16120.0°120.0°
CAICADCACH1746.4°43.8°
CAICADCACH18165.8°75.6°
CAOCANCASCAJ177.8°179.8°
CAOCANCAJCAF65.0°50.2°
CAOCANCAJCAK118.8°129.5°
CAOCANCASH6179.7°179.8°
CANCAOCAPH10176.2°179.8°
CASCANCAJCAF117.4°130.0°
CASCANCAJCAK58.9°50.3°
CASCANCAOH11176.1°179.9°
NAECADCACH13119.4°120.2°
CADNAECAFH12121.8°125.1°
CADNAECAFCAJ124.7°103.1°
CADNAECAFCAG61.2°78.2°
NAECADCACCAB48.0°43.8°
NAECADCAIH14180.0°60.0°
NAECADCAIH1560.0°180.0°
NAECADCAIH1660.0°60.0°
NAECADCACH17168.3°76.5°
NAECADCACH1872.4°164.1°
CACCADNAECAF35.0°44.2°
CADCACCABH17120.3°120.2°
CADCACCABH18120.3°120.3°
CADCACCABOAH102.8°103.8°
CADCACCABNAA78.2°76.1°
CACCADNAEH12156.9°80.8°
CACCADCAIH1457.1°179.0°
CACCADCAIH1562.9°59.0°
CACCADCAIH16177.1°61.0°
CADCACH17H18119.1°119.5°
CANCAJCAFNAE0.8°2.0°
CANCAJCAFCAK176.3°179.7°
CANCAJCAFCAG174.9°179.3°
CANCAJCAKCAL177.9°179.7°
CAJCANCASH62.5°0.0°
CAJCANCAOH116.2°0.1°
CANCAJCAKH222.1°0.0°
NAECAFCAJCAG174.2°178.7°
NAECAFCAJCAK175.5°177.8°
NAECAFCAGNAA3.8°2.8°
NAECAFCAGCAM175.4°177.7°
CAFNAECADH1383.8°164.5°
CAFCAJCAKCAL1.5°0.5°
CAJCAFCAGNAA170.2°178.5°
CAJCAFCAGCAM1.4°1.0°
CAJCAFNAEH122.9°131.8°
CAFCAJCAKH22178.5°179.7°
CAKCAJCAFCAG1.4°0.9°
CAJCAKCALH22180.0°179.7°
CAJCAKCALCAM4.3°0.2°
CAJCAKCALH21175.6°180.0°
CAFCAGNAACAB42.3°48.6°
CAFCAGNAACAM171.9°179.5°
CAFCAGCAMCAL1.5°0.6°
CAGCAFNAEH12177.0°46.9°
CAFCAGNAAH19137.7°131.4°
CAFCAGCAMH20178.5°179.4°
CACCABOAHNAA179.0°179.9°
CACCABNAACAG12.3°3.3°
CABCACCADH13167.4°76.5°
CABCACH17H18119.1°119.6°
CACCABNAAH19167.7°176.6°
OAHCABNAACAG168.7°176.6°
OAHCABCACH1717.5°135.9°
OAHCABCACH18136.9°16.5°
OAHCABNAAH1911.3°3.5°
CABNAACAGH19180.0°180.0°
CABNAACAGCAM145.9°130.9°
NAACABCACH17161.5°44.2°
NAACABCACH1842.1°163.6°
CAKCALCAMCAG4.3°0.2°
CAKCALCAMH21180.0°179.8°
CAKCALCAMH20175.7°179.8°
NAACAGCAMCAL173.4°178.8°
NAACAGCAMH206.6°1.2°
CAGCAMCALH20180.0°180.0°
CAMCAGNAAH1934.2°49.1°
CAGCAMCALH21175.7°180.0°
CAMCALCAKH22175.7°179.9°
H1CAYCAZH3140.9°145.0°
H1CAYCAZH40.0°0.1°
H1CAYCAWH5144.2°145.1°
H2CAYCAZH30.0°0.1°
H2CAYCAZH4141.0°144.9°
H2CAYCAWH53.3°0.0°
H3CAZCAWH53.1°0.0°
H4CAZCAWH5144.2°145.0°
H7CAXH8H9120.0°120.0°
H10CAPCAOH113.8°0.1°
H12NAECADH1338.0°39.4°
H13CADCAIH1461.4°59.5°
H13CADCAIH15178.6°60.5°
H13CADCAIH1658.7°179.5°
H13CADCACH1772.3°163.3°
H13CADCACH1847.1°43.8°
H14CAIH15H16120.0°120.0°
H20CAMCALH214.3°0.0°
H21CALCAKH224.4°0.3°

223532

PDB entries from 2024-08-07

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