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SummaryGeometryRelated PDB entries

ROA

Bonds
First atomSecond atomBond order typeDistance
(experimental model)		Distance
(ideal model)		Properties
CAUCAVdoub1.38Å1.40ÅAromatic
CAUCASsing1.38Å1.39ÅAromatic
CAUHAUsing1.08Å1.08Å
CAVOAYsing1.36Å1.37Å
CAVCAWsing1.39Å1.40ÅAromatic
OAYHOAYsing0.97Å0.95Å
CAWOAZsing1.36Å1.38Å
CAWCAXdoub1.38Å1.41ÅAromatic
OAZHOAZsing0.97Å0.95Å
CAXCATsing1.38Å1.40ÅAromatic
CAXHAXsing1.08Å1.08Å
CATCASdoub1.38Å1.42ÅAromatic
CATHATsing1.08Å1.08Å
CASCAOsing1.51Å1.42Å
CAOCANsing1.53Å1.53Å
CAOHAOsing1.09Å1.10Å
CAOHAOAsing1.09Å1.10Å
CANCAPsing1.51Å1.55Å
CANOAMsing1.43Å1.43Å
CANHANsing1.09Å1.10Å
CAPOARdoub1.21Å1.26Å
CAPOAQsing1.34Å1.26Å
OAQH18sing0.97Å0.95Å
OAMCAKsing1.35Å1.37Å
CAKOALdoub1.22Å1.24Å
CAKCAJsing1.42Å1.49Å
CAJCAIdoub1.35Å1.50Å
CAJHAJsing1.08Å1.08Å
CAICACsing1.47Å1.37Å
CAIHAIsing1.08Å1.08Å
CACCADdoub1.40Å1.36ÅAromatic
CACCAAsing1.40Å1.41ÅAromatic
CADCAEsing1.38Å1.38ÅAromatic
CADHADsing1.08Å1.08Å
CAEOAGsing1.36Å1.37Å
CAECAFdoub1.40Å1.42ÅAromatic
OAGHOAGsing0.97Å0.95Å
CAFOAHsing1.36Å1.36Å
CAFCABsing1.39Å1.41ÅAromatic
OAHHOAHsing0.97Å0.95Å
CABCAAdoub1.38Å1.40ÅAromatic
CABHABsing1.08Å1.08Å
CAAHAAsing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)		Angle
(ideal model)
CAVCAUCAS119.6°120.0°
CAVCAUHAU120.2°120.0°
CAUCAVOAY120.8°120.0°
CAUCAVCAW121.5°119.9°
CASCAUHAU120.2°120.0°
CAUCASCAT118.6°120.1°
CAUCASCAO117.9°119.9°
OAYCAVCAW117.7°120.1°
CAVOAYHOAY109.5°114.0°
CAVCAWOAZ116.2°120.1°
CAVCAWCAX119.9°119.9°
OAZCAWCAX124.0°120.1°
CAWOAZHOAZ109.5°114.0°
CAWCAXCAT117.9°120.0°
CAWCAXHAX121.1°120.0°
CATCAXHAX121.0°120.0°
CAXCATCAS122.4°120.1°
CAXCATHAT118.8°119.9°
CASCATHAT118.8°119.9°
CATCASCAO123.5°119.9°
CASCAOCAN114.7°109.4°
CASCAOHAO108.2°109.5°
CASCAOHAOA108.2°109.5°
CANCAOHAO108.1°109.5°
CANCAOHAOA108.2°109.5°
CAOCANCAP113.5°109.5°
CAOCANOAM108.6°109.5°
CAOCANHAN108.5°109.5°
HAOCAOHAOA109.5°109.5°
CAPCANOAM108.1°109.5°
CAPCANHAN108.2°109.5°
CANCAPOAR115.0°120.0°
CANCAPOAQ119.1°120.0°
OAMCANHAN109.9°109.5°
CANOAMCAK117.6°117.0°
OARCAPOAQ125.6°120.0°
CAPOAQH18109.5°117.0°
OAMCAKOAL129.0°120.0°
OAMCAKCAJ111.3°120.0°
OALCAKCAJ119.7°120.0°
CAKCAJCAI114.4°120.0°
CAKCAJHAJ122.8°120.0°
CAICAJHAJ122.8°120.0°
CAJCAICAC108.8°120.0°
CAJCAIHAI125.6°120.0°
CACCAIHAI125.6°120.0°
CAICACCAD114.7°120.1°
CAICACCAA122.0°120.1°
CADCACCAA123.3°119.8°
CACCADCAE117.6°119.8°
CACCADHAD121.2°120.0°
CACCAACAB120.3°120.0°
CACCAAHAA119.8°120.0°
CAECADHAD121.2°120.1°
CADCAEOAG117.4°120.0°
CADCAECAF120.8°120.0°
OAGCAECAF121.8°120.0°
CAEOAGHOAG109.5°114.0°
CAECAFOAH117.9°119.9°
CAECAFCAB121.6°120.2°
OAHCAFCAB120.5°119.9°
CAFOAHHOAH109.5°114.0°
CAFCABCAA116.4°120.2°
CAFCABHAB121.8°119.9°
CAACABHAB121.8°119.9°
CABCAAHAA119.8°120.1°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)		Torsion
(ideal model)
CAVCAUCASHAU180.0°179.7°
CAUCAVOAYCAW179.1°180.0°
CAUCAVOAYHOAY180.0°90.0°
CAUCAVCAWOAZ179.5°180.0°
CAUCAVCAWCAX0.4°0.0°
CAVCAUCASCAT0.5°0.0°
CAVCAUCASCAO178.6°180.0°
CASCAUCAVOAY179.2°180.0°
CASCAUCAVCAW0.2°0.0°
CAUCASCATCAX1.1°0.0°
CAUCASCATCAO178.0°180.0°
CAUCASCATHAT178.9°179.9°
CAUCASCAOCAN100.3°90.0°
CAUCASCAOHAO138.9°150.0°
CAUCASCAOHAOA20.4°30.0°
HAUCAUCAVOAY0.8°0.3°
HAUCAUCAVCAW179.8°179.7°
HAUCAUCASCAT179.5°179.7°
HAUCAUCASCAO1.3°0.2°
OAYCAVCAWOAZ0.4°0.0°
OAYCAVCAWCAX179.4°180.0°
CAWCAVOAYHOAY0.9°90.0°
CAVCAWOAZCAX179.8°180.0°
CAVCAWOAZHOAZ180.0°90.0°
CAVCAWCAXCAT0.9°0.0°
CAVCAWCAXHAX179.1°180.0°
OAZCAWCAXCAT178.9°180.0°
OAZCAWCAXHAX1.1°0.0°
CAXCAWOAZHOAZ0.2°90.0°
CAWCAXCATHAX180.0°179.9°
CAWCAXCATCAS1.2°0.0°
CAWCAXCATHAT178.7°179.9°
CAXCATCASHAT180.0°180.0°
CAXCATCASCAO179.1°180.0°
HAXCAXCATCAS178.7°180.0°
HAXCAXCATHAT1.3°0.0°
CATCASCAOCAN81.6°90.0°
CATCASCAOHAO39.1°30.0°
CATCASCAOHAOA157.6°150.0°
HATCATCASCAO0.9°0.0°
CASCAOCANHAO120.8°120.0°
CASCAOCANHAOA120.8°120.0°
CASCAOHAOHAOA117.6°120.0°
CASCAOCANCAP167.3°175.0°
CASCAOCANOAM72.5°65.0°
CASCAOCANHAN46.9°55.0°
CANCAOHAOHAOA117.6°120.0°
CAOCANCAPOAM120.5°120.0°
CAOCANCAPHAN120.6°120.0°
CAOCANOAMHAN118.6°120.0°
CAOCANCAPOAR133.2°115.0°
CAOCANCAPOAQ52.9°65.0°
CAOCANOAMCAK178.3°150.0°
HAOCAOCANCAP72.0°65.0°
HAOCAOCANOAM48.2°55.0°
HAOCAOCANHAN167.6°175.0°
HAOACAOCANCAP46.5°55.0°
HAOACAOCANOAM166.7°175.0°
HAOACAOCANHAN73.9°65.0°
CAPCANOAMHAN117.9°120.0°
CANCAPOAROAQ173.5°179.9°
CANCAPOAQH18173.2°180.0°
CAPCANOAMCAK58.2°90.0°
OAMCANCAPOAR106.3°5.0°
OAMCANCAPOAQ67.6°175.0°
CANOAMCAKOAL0.3°0.0°
CANOAMCAKCAJ179.7°180.0°
HANCANCAPOAR12.6°125.0°
HANCANCAPOAQ173.5°55.0°
HANCANOAMCAK59.7°30.0°
OARCAPOAQH180.0°0.1°
OAMCAKOALCAJ179.4°180.0°
OAMCAKCAJCAI177.8°180.0°
OAMCAKCAJHAJ2.2°0.0°
OALCAKCAJCAI2.7°0.0°
OALCAKCAJHAJ177.3°180.0°
CAKCAJCAIHAJ180.0°180.0°
CAKCAJCAICAC179.0°180.0°
CAKCAJCAIHAI1.0°0.0°
CAJCAICACHAI180.0°180.0°
CAJCAICACCAD132.8°180.0°
CAJCAICACCAA45.9°0.3°
HAJCAJCAICAC1.0°0.0°
HAJCAJCAIHAI179.0°180.0°
CAICACCADCAA178.6°179.7°
CAICACCADCAE178.3°180.0°
CAICACCADHAD1.7°0.1°
CAICACCAACAB178.1°179.8°
CAICACCAAHAA1.9°0.0°
HAICAICACCAD47.2°0.0°
HAICAICACCAA134.1°179.8°
CACCADCAEHAD180.0°179.9°
CACCADCAEOAG178.9°180.0°
CACCADCAECAF0.1°0.0°
CADCACCAACAB0.4°0.5°
CADCACCAAHAA179.5°179.7°
CAACACCADCAE0.3°0.3°
CAACACCADHAD179.6°179.8°
CACCAACABCAF0.1°0.4°
CACCAACABHAA180.0°179.8°
CACCAACABHAB179.9°179.8°
CADCAEOAGCAF178.8°180.0°
CADCAEOAGHOAG180.0°90.0°
CADCAECAFOAH179.8°179.9°
CADCAECAFCAB0.4°0.0°
HADCADCAEOAG1.2°0.1°
HADCADCAECAF179.9°180.0°
OAGCAECAFOAH1.5°0.1°
OAGCAECAFCAB179.2°180.0°
CAFCAEOAGHOAG1.2°90.0°
CAECAFOAHCAB179.4°179.9°
CAECAFOAHHOAH180.0°90.0°
CAECAFCABCAA0.3°0.2°
CAECAFCABHAB179.7°180.0°
OAHCAFCABCAA179.6°179.7°
OAHCAFCABHAB0.4°0.1°
CABCAFOAHHOAH0.6°89.9°
CAFCABCAAHAB180.0°179.8°
CAFCABCAAHAA179.9°179.8°
HABCABCAAHAA0.1°0.1°

246704

PDB entries from 2025-12-24

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