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8PT

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
N9C8doub1.30Å1.33ÅAromatic
N9C4sing1.35Å1.34ÅAromatic
C8N7sing1.35Å1.36ÅAromatic
C4N3doub1.34Å1.35ÅAromatic
C4C5sing1.40Å1.37ÅAromatic
N3C2sing1.32Å1.36ÅAromatic
N7C5sing1.38Å1.32ÅAromatic
C5C6doub1.40Å1.35ÅAromatic
C2N2sing1.39Å1.33Å
C2N1doub1.33Å1.31ÅAromatic
N2CAMsing1.40Å1.38Å
C6N1sing1.33Å1.31ÅAromatic
C6N6sing1.38Å1.34Å
CASCARsing1.51Å1.39Å
CAMCARdoub1.39Å1.41ÅAromatic
CAMCANsing1.39Å1.41ÅAromatic
N6CAKsing1.46Å1.42Å
CAKCAYsing1.53Å1.52Å
CAKCAUsing1.53Å1.56Å
CARCAQsing1.38Å1.38ÅAromatic
CANCAOdoub1.38Å1.39ÅAromatic
CAYCAXsing1.53Å1.48Å
CAUCAVsing1.53Å1.54Å
CAQCAPdoub1.39Å1.38ÅAromatic
CAXCAWsing1.53Å1.53Å
CAOCAPsing1.39Å1.40ÅAromatic
CAPNATsing1.40Å1.34Å
CAVCAWsing1.53Å1.56Å
NATCAZsing1.47Å1.47Å
NATCBDsing1.47Å1.48Å
CAZCBAsing1.53Å1.53Å
CBDCBCsing1.53Å1.54Å
CBAOBBsing1.43Å1.45Å
CBCOBBsing1.43Å1.43Å
C8H1sing1.08Å1.08Å
CAUH2sing1.09Å1.10Å
CAVH3sing1.09Å1.10Å
CAWH4sing1.09Å1.10Å
CAWH5sing1.09Å1.10Å
CAXH6sing1.09Å1.10Å
CAXH7sing1.09Å1.10Å
CAYH8sing1.09Å1.10Å
CAYH9sing1.09Å1.10Å
CAKH10sing1.09Å1.10Å
N6H11sing0.97Å1.00Å
N7H12sing0.97Å1.00Å
N2H14sing0.97Å1.00Å
CASH15sing1.09Å1.10Å
CASH16sing1.09Å1.10Å
CASH17sing1.09Å1.10Å
CAQH18sing1.08Å1.08Å
CANH19sing1.08Å1.08Å
CAOH20sing1.08Å1.08Å
CAZH21sing1.09Å1.10Å
CAZH22sing1.09Å1.10Å
CBAH23sing1.09Å1.10Å
CBAH24sing1.09Å1.10Å
CBCH25sing1.09Å1.10Å
CBCH26sing1.09Å1.10Å
CBDH27sing1.09Å1.10Å
CBDH28sing1.09Å1.10Å
CAUH13sing1.09Å1.10Å
CAVH29sing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C8N9C4105.7°109.8°
N9C8N7110.0°110.1°
N9C8H1125.0°124.9°
N9C4N3129.6°134.4°
N9C4C5109.6°106.8°
C8N7C5107.6°107.1°
N7C8H1125.0°124.9°
C8N7H12126.2°126.4°
N3C4C5120.7°118.8°
C4N3C2118.0°120.5°
C4C5N7107.0°106.1°
C4C5C6118.4°118.7°
N3C2N2127.1°118.8°
N3C2N1120.4°122.3°
N7C5C6134.6°135.1°
C5N7H12126.2°126.5°
C5C6N1119.7°118.6°
C5C6N6131.0°120.7°
N2C2N1112.5°118.9°
C2N2CAM118.1°120.0°
C2N2H14121.0°120.0°
C2N1C6122.7°121.1°
N2CAMCAR117.1°120.0°
N2CAMCAN123.7°120.0°
CAMN2H14120.9°120.0°
N1C6N6109.2°120.7°
C6N6CAK132.3°120.1°
C6N6H11103.5°120.0°
CASCARCAM122.5°120.0°
CASCARCAQ118.0°120.0°
CARCASH15109.5°109.5°
CARCASH16109.5°109.4°
CARCASH17109.5°109.4°
CARCAMCAN119.2°120.0°
CAMCARCAQ119.6°120.0°
CAMCANCAO120.4°120.0°
CAMCANH19119.8°120.0°
N6CAKCAY110.1°109.5°
N6CAKCAU108.5°109.5°
N6CAKH10111.4°109.5°
CAKN6H11103.5°120.0°
CAYCAKCAU107.6°109.5°
CAKCAYCAX109.6°109.5°
CAKCAYH8109.4°109.5°
CAKCAYH9109.5°109.4°
CAYCAKH10109.8°109.4°
CAKCAUCAV118.6°109.5°
CAKCAUH2107.2°109.5°
CAUCAKH10109.3°109.4°
CAKCAUH13107.1°109.4°
CARCAQCAP121.2°120.0°
CARCAQH18119.4°120.0°
CANCAOCAP119.6°120.0°
CAOCANH19119.8°120.1°
CANCAOH20120.2°119.9°
CAYCAXCAW104.1°109.5°
CAYCAXH6110.8°109.5°
CAYCAXH7110.8°109.5°
CAXCAYH8109.4°109.5°
CAXCAYH9109.4°109.5°
CAUCAVCAW116.2°109.5°
CAVCAUH2107.1°109.5°
CAUCAVH3107.8°109.5°
CAVCAUH13107.2°109.5°
CAUCAVH29107.8°109.5°
CAQCAPCAO120.0°120.0°
CAQCAPNAT118.3°120.0°
CAPCAQH18119.4°120.0°
CAXCAWCAV114.4°109.5°
CAXCAWH4108.2°109.5°
CAXCAWH5108.2°109.5°
CAWCAXH6110.8°109.4°
CAWCAXH7110.8°109.4°
CAOCAPNAT121.7°120.0°
CAPCAOH20120.2°120.0°
CAPNATCAZ118.2°111.0°
CAPNATCBD121.3°111.0°
CAWCAVH3107.7°109.5°
CAVCAWH4108.2°109.5°
CAVCAWH5108.3°109.5°
CAWCAVH29107.8°109.5°
CAZNATCBD120.5°110.7°
NATCAZCBA106.0°109.3°
NATCAZH21110.3°109.5°
NATCAZH22110.3°109.5°
NATCBDCBC113.6°109.2°
NATCBDH27108.5°109.5°
NATCBDH28108.4°109.5°
CAZCBAOBB108.3°109.2°
CBACAZH21110.3°109.5°
CBACAZH22110.3°109.4°
CAZCBAH23109.8°109.5°
CAZCBAH24109.8°109.5°
CBDCBCOBB111.8°109.3°
CBDCBCH25108.9°109.5°
CBDCBCH26108.9°109.5°
CBCCBDH27108.4°109.5°
CBCCBDH28108.4°109.5°
CBAOBBCBC113.2°113.8°
OBBCBAH23109.7°109.5°
OBBCBAH24109.8°109.5°
OBBCBCH25108.9°109.5°
OBBCBCH26108.9°109.5°
H2CAUH13109.5°109.5°
H3CAVH29109.5°109.4°
H4CAWH5109.5°109.4°
H6CAXH7109.5°109.5°
H8CAYH9109.5°109.4°
H15CASH16109.4°109.5°
H15CASH17109.5°109.5°
H16CASH17109.5°109.5°
H21CAZH22109.5°109.5°
H23CBAH24109.5°109.6°
H25CBCH26109.5°109.5°
H27CBDH28109.4°109.6°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
N9C8N7H1180.0°179.7°
C8N9C4N3179.4°179.8°
C8N9C4C50.9°0.4°
N9C8N7C50.5°0.2°
N9C8N7H12179.5°179.9°
C4N9C8N70.9°0.4°
N9C4N3C5178.3°179.8°
N9C4N3C2178.6°179.7°
N9C4C5N70.6°0.2°
N9C4C5C6179.8°179.8°
C4N9C8H1179.1°179.9°
C8N7C5C40.1°0.0°
C8N7C5H12180.0°179.8°
C8N7C5C6179.6°180.0°
N3C4C5N7179.2°179.9°
N3C4C5C61.2°0.1°
C4N3C2N2179.6°180.0°
C4N3C2N10.7°0.1°
C5C4N3C20.3°0.1°
C4C5N7C6179.5°180.0°
C4C5C6N11.0°0.1°
C4C5C6N6179.1°179.9°
C4C5N7H12179.9°179.9°
N3C2N2N1179.0°179.9°
N3C2N2CAM177.9°5.9°
N3C2N1C60.9°0.1°
N3C2N2H142.1°174.0°
N7C5C6N1179.5°180.0°
N7C5C6N61.4°0.0°
C5N7C8H1179.5°180.0°
C5C6N1C20.0°0.1°
C5C6N1N6178.5°180.0°
C5C6N6CAK11.1°180.0°
C5C6N6H11134.0°0.0°
C6C5N7H120.4°0.2°
C2N2CAMH14180.0°180.0°
N2C2N1C6180.0°180.0°
C2N2CAMCAR138.8°155.2°
C2N2CAMCAN41.4°25.1°
N1C2N2CAM1.1°174.1°
C2N1C6N6178.4°180.0°
N1C2N2H14178.9°5.9°
N2CAMCARCAS1.0°0.0°
N2CAMCARCAN179.9°179.7°
N2CAMCARCAQ179.5°179.9°
N2CAMCANCAO179.1°180.0°
N2CAMCANH190.9°0.0°
N1C6N6CAK170.7°0.0°
N1C6N6H1147.8°180.0°
C6N6CAKH11122.9°179.9°
C6N6CAKCAY122.3°155.0°
C6N6CAKCAU120.2°85.0°
C6N6CAKH100.2°35.0°
CASCARCAMCAQ179.5°180.0°
CASCARCAMCAN179.2°179.7°
CASCARCAQCAP179.7°180.0°
CARCASH15H16120.0°120.0°
CARCASH15H17120.0°120.0°
CARCASH16H17120.0°120.0°
CASCARCAQH180.3°0.1°
CARCAMCANCAO0.7°0.3°
CAMCARCAQCAP0.2°0.0°
CARCAMN2H1441.2°24.8°
CAMCARCASH1590.3°90.0°
CAMCARCASH16149.7°150.0°
CAMCARCASH1729.7°30.0°
CAMCARCAQH18179.9°180.0°
CARCAMCANH19179.2°179.7°
CANCAMCARCAQ0.4°0.2°
CAMCANCAOH19180.0°180.0°
CAMCANCAOCAP0.6°0.0°
CANCAMN2H14138.6°154.9°
CAMCANCAOH20179.4°180.0°
N6CAKCAYCAU118.1°120.1°
N6CAKCAYH10123.0°120.0°
N6CAKCAUH10121.7°120.0°
N6CAKCAYCAX53.0°180.0°
N6CAKCAUCAV87.4°180.0°
N6CAKCAUH2151.3°60.0°
N6CAKCAYH867.0°60.0°
N6CAKCAYH9173.0°60.0°
N6CAKCAUH1333.9°59.9°
CAYCAKCAUH10119.2°119.9°
CAKCAYCAXH8120.0°120.0°
CAKCAYCAXH9120.0°120.0°
CAYCAKCAUCAV31.7°60.0°
CAKCAYCAXCAW77.8°60.0°
CAYCAKCAUH289.6°60.0°
CAKCAYCAXH641.4°60.0°
CAKCAYCAXH7163.1°180.0°
CAKCAYH8H9120.0°120.0°
CAYCAKN6H11114.8°25.1°
CAYCAKCAUH13153.0°180.0°
CAUCAKCAYCAX65.1°60.0°
CAKCAUCAVH2121.3°120.0°
CAKCAUCAVH13121.3°120.0°
CAKCAUCAVCAW14.5°60.0°
CAKCAUH2H13115.8°120.0°
CAKCAUCAVH3135.4°60.0°
CAUCAKCAYH8174.9°180.0°
CAUCAKCAYH954.9°60.1°
CAUCAKN6H112.7°95.0°
CAKCAUCAVH29106.5°180.0°
CARCAQCAPH18180.0°180.0°
CARCAQCAPCAO0.3°0.2°
CARCAQCAPNAT179.0°180.0°
CAQCARCASH1590.2°90.0°
CAQCARCASH1629.8°30.0°
CAQCARCASH17149.8°150.0°
CANCAOCAPCAQ0.1°0.2°
CANCAOCAPH20180.0°179.9°
CANCAOCAPNAT179.3°180.0°
CAYCAXCAWH6119.1°120.0°
CAYCAXCAWH7119.1°120.0°
CAYCAXCAWCAV55.7°60.0°
CAYCAXCAWH4176.4°180.0°
CAYCAXCAWH565.0°60.0°
CAYCAXH6H7122.5°120.1°
CAXCAYH8H9119.9°120.0°
CAXCAYCAKH10176.0°60.0°
CAUCAVCAWCAX26.4°60.0°
CAUCAVCAWH3121.0°120.0°
CAUCAVCAWH29121.0°120.0°
CAVCAUH2H13115.9°120.0°
CAUCAVH3H29117.0°120.0°
CAUCAVCAWH4147.1°180.0°
CAUCAVCAWH594.3°60.0°
CAVCAUCAKH10150.9°60.0°
CAQCAPCAONAT179.3°179.8°
CAQCAPNATCAZ51.8°180.0°
CAQCAPNATCBD127.8°56.4°
CAQCAPCAOH20179.9°179.7°
CAXCAWCAVH4120.7°120.1°
CAXCAWCAVH5120.7°120.0°
CAXCAWCAVH3147.4°60.0°
CAXCAWH4H5117.7°120.0°
CAWCAXH6H7122.5°119.9°
CAWCAXCAYH8162.2°180.0°
CAWCAXCAYH942.3°60.0°
CAXCAWCAVH2994.5°180.0°
CAOCAPNATCAZ127.4°0.2°
CAOCAPNATCBD53.0°123.4°
CAOCAPCAQH18179.7°179.8°
CAPCAOCANH19179.4°179.9°
CAPNATCAZCBD179.6°123.7°
CAPNATCAZCBA177.9°177.6°
CAPNATCBDCBC141.3°177.6°
NATCAPCAQH181.0°0.0°
NATCAPCAOH200.7°0.0°
CAPNATCAZH2158.4°62.4°
CAPNATCAZH2262.7°57.7°
CAPNATCBDH2720.7°57.7°
CAPNATCBDH2898.1°62.5°
CAWCAVCAUH2106.8°60.0°
CAWCAVH3H29117.0°120.0°
CAVCAWH4H5117.8°120.0°
CAVCAWCAXH663.4°60.0°
CAVCAWCAXH7174.8°180.0°
CAWCAVCAUH13135.8°180.0°
NATCAZCBAH21119.5°120.0°
NATCAZCBAH22119.5°119.9°
CAZNATCBDCBC39.1°58.6°
NATCAZCBAOBB55.5°56.9°
NATCAZH21H22121.6°120.1°
NATCAZCBAH2364.3°176.8°
NATCAZCBAH24175.4°63.0°
CAZNATCBDH27159.7°178.5°
CAZNATCBDH2881.5°61.3°
CBDNATCAZCBA1.7°58.7°
NATCBDCBCH27120.6°119.9°
NATCBDCBCH28120.6°119.9°
NATCBDCBCOBB24.7°56.8°
CBDNATCAZH21121.2°61.3°
CBDNATCAZH22117.7°178.6°
NATCBDCBCH2595.6°176.8°
NATCBDCBCH26145.0°63.1°
NATCBDH27H28118.1°120.1°
CAZCBAOBBH23119.8°119.9°
CAZCBAOBBH24119.8°119.9°
CAZCBAOBBCBC73.3°58.7°
CBACAZH21H22121.6°120.0°
CAZCBAH23H24120.5°120.1°
CBDCBCOBBCBA28.6°58.7°
CBDCBCOBBH25120.4°119.9°
CBDCBCOBBH26120.3°120.0°
CBDCBCH25H26119.0°120.1°
CBCCBDH27H28118.1°120.1°
OBBCBACAZH21175.0°63.1°
OBBCBACAZH2263.9°176.8°
OBBCBAH23H24120.5°120.2°
CBAOBBCBCH25149.0°178.6°
CBAOBBCBCH2691.7°61.2°
CBCOBBCBAH2346.5°178.6°
CBCOBBCBAH24166.8°61.2°
OBBCBCH25H26118.9°120.1°
OBBCBCCBDH27145.3°176.8°
OBBCBCCBDH2895.9°63.0°
H1C8N7H120.5°0.2°
H2CAUCAVH314.1°180.0°
H2CAUCAKH1029.6°180.0°
H2CAUCAVH29132.2°60.0°
H3CAVCAWH491.9°60.0°
H3CAVCAWH526.7°180.0°
H3CAVCAUH13103.3°59.9°
H4CAWCAXH657.3°60.0°
H4CAWCAXH764.5°59.9°
H4CAWCAVH2926.1°60.0°
H5CAWCAXH6175.9°180.0°
H5CAWCAXH754.1°60.0°
H5CAWCAVH29144.8°60.0°
H6CAXCAYH878.6°60.0°
H6CAXCAYH9161.4°180.0°
H7CAXCAYH843.1°60.0°
H7CAXCAYH976.9°60.0°
H8CAYCAKH1056.0°60.0°
H9CAYCAKH1064.0°NaN°
H10CAKN6H11123.1°145.1°
H10CAKCAUH1387.8°60.1°
H15CASH16H17120.0°120.1°
H19CANCAOH200.6°0.0°
H21CAZCBAH2355.2°56.8°
H21CAZCBAH2465.2°177.0°
H22CAZCBAH23176.3°63.2°
H22CAZCBAH2455.9°56.9°
H25CBCCBDH2725.0°63.3°
H25CBCCBDH28143.7°56.9°
H26CBCCBDH2794.3°56.8°
H26CBCCBDH2824.4°177.0°
H13CAUCAVH2914.8°60.0°

223532

PDB entries from 2024-08-07

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