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ED7

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
CBACAAsing1.51Å1.54Å
CAAHAAsing1.09Å1.10Å
CAAHAAAsing1.09Å1.10Å
CAAHAABsing1.09Å1.10Å
CBFCBAdoub1.38Å1.39ÅAromatic
CBACALsing1.38Å1.39ÅAromatic
CAJCALdoub1.38Å1.39ÅAromatic
CALHALsing1.08Å1.08Å
CAKCAJsing1.38Å1.39ÅAromatic
CAJHAJsing1.08Å1.08Å
CAQCAKdoub1.38Å1.39ÅAromatic
CAKHAKsing1.08Å1.08Å
CAQCBFsing1.38Å1.39ÅAromatic
CAQHAQsing1.08Å1.08Å
SBJCBFsing1.76Å1.74Å
OADSBJdoub1.42Å1.50Å
OAESBJdoub1.42Å1.51Å
SBJNBHsing1.66Å1.67Å
CAXNBHsing1.47Å1.48Å
NBHCAWsing1.46Å1.50Å
CAXCBCsing1.51Å1.52Å
CAXHAXsing1.09Å1.10Å
CAXHAXAsing1.09Å1.10Å
CBCCAMdoub1.38Å1.39ÅAromatic
CBCCANsing1.38Å1.39ÅAromatic
CAMCAHsing1.38Å1.39ÅAromatic
CAMHAMsing1.08Å1.08Å
CAHCAGdoub1.38Å1.39ÅAromatic
CAHHAHsing1.08Å1.08Å
CAICAGsing1.38Å1.39ÅAromatic
CAGHAGsing1.08Å1.08Å
CANCAIdoub1.38Å1.39ÅAromatic
CAIHAIsing1.08Å1.08Å
CANHANsing1.08Å1.08Å
CAVCAWsing1.53Å1.52Å
CAWHAWsing1.09Å1.10Å
CAWHAWAsing1.09Å1.10Å
CAVNBGsing1.47Å1.48Å
CAVHAVsing1.09Å1.10Å
CAVHAVAsing1.09Å1.10Å
NBGCAYsing1.46Å1.46Å
NBGCBDsing1.39Å1.35Å
CASCBDdoub1.39Å1.40ÅAromatic
CBDCARsing1.39Å1.39ÅAromatic
CARCAOdoub1.38Å1.40ÅAromatic
CARHARsing1.08Å1.08Å
CBBCAOsing1.40Å1.39ÅAromatic
CAOHAOsing1.08Å1.08Å
CAPCBBdoub1.40Å1.39ÅAromatic
CBBCAFsing1.43Å1.42Å
CAFNACtrip1.14Å1.14Å
CASCAPsing1.38Å1.40ÅAromatic
CAPHAPsing1.08Å1.08Å
CASHASsing1.08Å1.08Å
CAYCBEsing1.51Å1.53Å
CAYHAYsing1.09Å1.10Å
CAYHAYAsing1.09Å1.10Å
CBENBIsing1.37Å1.33ÅAromatic
CBECATdoub1.35Å1.34ÅAromatic
CATNAZsing1.34Å1.35ÅAromatic
CATHATsing1.08Å1.08Å
CAUNAZdoub1.30Å1.33ÅAromatic
NBICAUsing1.35Å1.33ÅAromatic
CAUHAUsing1.08Å1.08Å
CABNBIsing1.46Å1.50Å
CABHABsing1.09Å1.10Å
CABHABAsing1.09Å1.10Å
CABHABBsing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
CBACAAHAA109.5°109.5°
CBACAAHAAA109.5°109.5°
CBACAAHAAB109.5°109.4°
CAACBACBF120.8°120.0°
CAACBACAL120.1°120.1°
HAACAAHAAA109.5°109.5°
HAACAAHAAB109.4°109.5°
HAAACAAHAAB109.5°109.5°
CBFCBACAL119.1°120.0°
CBACBFCAQ120.9°120.0°
CBACBFSBJ120.5°120.0°
CBACALCAJ120.0°120.1°
CBACALHAL120.0°119.9°
CAJCALHAL120.0°120.0°
CALCAJCAK120.9°120.0°
CALCAJHAJ119.6°120.0°
CAKCAJHAJ119.5°119.9°
CAJCAKCAQ119.1°119.9°
CAJCAKHAK120.5°120.0°
CAQCAKHAK120.5°120.1°
CAKCAQCBF120.0°120.0°
CAKCAQHAQ120.0°120.0°
CBFCAQHAQ120.0°120.0°
CAQCBFSBJ118.6°120.0°
CBFSBJOAD107.8°106.4°
CBFSBJOAE108.5°106.4°
CBFSBJNBH112.2°107.2°
OADSBJOAE108.6°123.1°
OADSBJNBH111.5°106.4°
OAESBJNBH108.1°106.4°
SBJNBHCAX107.8°120.0°
SBJNBHCAW117.6°120.0°
CAXNBHCAW114.4°120.0°
NBHCAXCBC109.5°109.5°
NBHCAXHAX109.5°109.5°
NBHCAXHAXA109.5°109.5°
NBHCAWCAV112.8°109.5°
NBHCAWHAW108.4°109.4°
NBHCAWHAWA107.6°109.5°
CBCCAXHAX109.4°109.5°
CBCCAXHAXA109.4°109.5°
CAXCBCCAM119.7°120.0°
CAXCBCCAN119.8°120.0°
HAXCAXHAXA109.5°109.4°
CAMCBCCAN120.6°120.0°
CBCCAMCAH119.1°120.0°
CBCCAMHAM120.5°120.0°
CBCCANCAI119.9°120.0°
CBCCANHAN120.0°120.0°
CAHCAMHAM120.4°119.9°
CAMCAHCAG120.9°119.9°
CAMCAHHAH119.5°120.0°
CAGCAHHAH119.6°120.0°
CAHCAGCAI119.5°120.0°
CAHCAGHAG120.2°120.0°
CAICAGHAG120.3°120.0°
CAGCAICAN120.0°120.0°
CAGCAIHAI120.0°120.0°
CANCAIHAI120.0°120.0°
CAICANHAN120.0°120.0°
CAVCAWHAW108.4°109.5°
CAVCAWHAWA107.7°109.5°
CAWCAVNBG110.5°109.4°
CAWCAVHAV109.1°109.5°
CAWCAVHAVA108.9°109.4°
HAWCAWHAWA112.1°109.5°
NBGCAVHAV109.1°109.5°
NBGCAVHAVA108.8°109.5°
CAVNBGCAY117.2°120.0°
CAVNBGCBD122.6°120.0°
HAVCAVHAVA110.3°109.5°
CAYNBGCBD119.2°120.0°
NBGCAYCBE114.0°109.5°
NBGCAYHAY108.0°109.4°
NBGCAYHAYA107.0°109.5°
NBGCBDCAS121.5°119.9°
NBGCBDCAR119.2°119.9°
CASCBDCAR119.2°120.1°
CBDCASCAP120.2°120.1°
CBDCASHAS119.9°120.0°
CBDCARCAO120.6°120.1°
CBDCARHAR119.7°120.0°
CAOCARHAR119.7°119.9°
CARCAOCBB119.7°119.9°
CARCAOHAO120.2°120.0°
CBBCAOHAO120.2°120.1°
CAOCBBCAP120.2°119.9°
CAOCBBCAF120.2°120.1°
CAPCBBCAF119.5°120.1°
CBBCAPCAS120.0°119.9°
CBBCAPHAP120.0°120.0°
CBBCAFNAC177.7°179.9°
CASCAPHAP120.0°120.0°
CAPCASHAS119.9°119.9°
CBECAYHAY108.0°109.5°
CBECAYHAYA107.0°109.5°
CAYCBENBI123.3°126.6°
CAYCBECAT129.4°126.6°
HAYCAYHAYA113.0°109.4°
NBICBECAT107.2°106.9°
CBENBICAU109.9°107.2°
CBENBICAB124.2°126.4°
CBECATNAZ107.4°108.0°
CBECATHAT126.3°126.0°
NAZCATHAT126.3°126.1°
CATNAZCAU108.8°109.3°
NAZCAUNBI106.7°108.7°
NAZCAUHAU126.6°125.7°
NBICAUHAU126.7°125.6°
CAUNBICAB126.0°126.4°
NBICABHAB109.5°109.5°
NBICABHABA109.5°109.5°
NBICABHABB109.4°109.4°
HABCABHABA109.5°109.5°
HABCABHABB109.4°109.4°
HABACABHABB109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
CBACAAHAAHAAA120.0°120.0°
CBACAAHAAHAAB120.0°119.9°
CBACAAHAAAHAAB120.0°119.9°
CAACBACBFCAL179.1°179.8°
CAACBACALCAJ179.6°179.9°
CAACBACALHAL0.4°0.0°
CAACBACBFCAQ179.8°179.6°
CAACBACBFSBJ1.3°0.2°
HAACAAHAAAHAAB120.0°120.0°
HAACAACBACBF74.8°84.8°
HAACAACBACAL106.2°95.4°
HAAACAACBACBF45.2°35.3°
HAAACAACBACAL133.8°144.5°
HAABCAACBACBF165.2°155.2°
HAABCAACBACAL13.8°24.6°
CBFCBACALCAJ0.5°0.3°
CBFCBACALHAL179.5°179.8°
CBACBFCAQCAK0.7°0.6°
CBACBFCAQSBJ178.9°179.4°
CBACBFCAQHAQ179.3°179.7°
CBACBFSBJOAD178.3°81.4°
CBACBFSBJOAE60.9°51.5°
CBACBFSBJNBH58.5°165.1°
CBACALCAJHAL180.0°180.0°
CBACALCAJCAK0.1°0.0°
CBACALCAJHAJ179.9°180.0°
CALCBACBFCAQ0.8°0.6°
CALCBACBFSBJ179.6°180.0°
CALCAJCAKHAJ180.0°180.0°
CALCAJCAKCAQ0.0°0.1°
CALCAJCAKHAK179.9°180.0°
HALCALCAJCAK179.8°180.0°
HALCALCAJHAJ0.2°0.0°
CAJCAKCAQHAK180.0°179.9°
CAJCAKCAQCBF0.3°0.4°
CAJCAKCAQHAQ179.7°180.0°
HAJCAJCAKCAQ179.9°179.9°
HAJCAJCAKHAK0.1°0.0°
CAKCAQCBFHAQ180.0°179.6°
CAKCAQCBFSBJ179.6°180.0°
HAKCAKCAQCBF179.7°179.7°
HAKCAKCAQHAQ0.3°0.1°
CAQCBFSBJOAD0.5°99.2°
CAQCBFSBJOAE118.0°127.9°
CAQCBFSBJNBH122.6°14.3°
HAQCAQCBFSBJ0.4°0.3°
CBFSBJOADOAE117.4°122.9°
CBFSBJOADNBH123.5°114.1°
CBFSBJOAENBH121.9°114.1°
CBFSBJNBHCAX172.6°95.2°
CBFSBJNBHCAW41.5°84.7°
OADSBJOAENBH121.2°123.0°
OADSBJNBHCAX51.6°151.2°
OADSBJNBHCAW79.5°28.8°
OAESBJNBHCAX67.8°18.3°
OAESBJNBHCAW161.2°161.7°
SBJNBHCAXCAW132.8°180.0°
SBJNBHCAXCBC172.7°95.0°
SBJNBHCAXHAX52.7°145.0°
SBJNBHCAXHAXA67.4°25.0°
SBJNBHCAWCAV71.5°94.4°
SBJNBHCAWHAW48.5°145.6°
SBJNBHCAWHAWA169.9°25.6°
NBHCAXCBCHAX120.0°120.0°
NBHCAXCBCHAXA120.0°120.0°
NBHCAXHAXHAXA120.0°120.0°
NBHCAXCBCCAM135.5°90.0°
NBHCAXCBCCAN43.6°90.3°
CAXNBHCAWCAV56.5°85.6°
CAXNBHCAWHAW176.5°34.3°
CAXNBHCAWHAWA62.1°154.4°
CAWNBHCAXCBC54.5°85.0°
CAWNBHCAXHAX174.5°35.0°
CAWNBHCAXHAXA65.5°155.0°
NBHCAWCAVHAW120.0°119.9°
NBHCAWCAVHAWA118.5°120.0°
NBHCAWHAWHAWA118.6°120.0°
NBHCAWCAVNBG161.4°180.0°
NBHCAWCAVHAV41.3°60.0°
NBHCAWCAVHAVA79.1°60.0°
CBCCAXHAXHAXA120.0°120.0°
CAXCBCCAMCAN179.1°179.7°
CAXCBCCAMCAH179.5°180.0°
CAXCBCCAMHAM0.5°0.1°
CAXCBCCANCAI179.5°179.8°
CAXCBCCANHAN0.5°0.0°
HAXCAXCBCCAM104.5°30.0°
HAXCAXCBCCAN76.4°149.7°
HAXACAXCBCCAM15.5°150.0°
HAXACAXCBCCAN163.6°29.7°
CBCCAMCAHHAM180.0°179.9°
CBCCAMCAHCAG0.3°0.1°
CBCCAMCAHHAH179.7°179.9°
CAMCBCCANCAI0.4°0.6°
CAMCBCCANHAN179.6°179.7°
CANCBCCAMCAH0.5°0.3°
CANCBCCAMHAM179.5°179.8°
CBCCANCAICAG0.2°0.5°
CBCCANCAIHAN180.0°179.8°
CBCCANCAIHAI179.8°179.7°
CAMCAHCAGHAH180.0°180.0°
CAMCAHCAGCAI0.1°0.0°
CAMCAHCAGHAG179.9°180.0°
HAMCAMCAHCAG179.7°180.0°
HAMCAMCAHHAH0.3°0.0°
CAHCAGCAIHAG180.0°180.0°
CAHCAGCAICAN0.1°0.3°
CAHCAGCAIHAI180.0°180.0°
HAHCAHCAGCAI179.9°180.0°
HAHCAHCAGHAG0.1°0.0°
CAGCAICANHAI180.0°179.7°
CAGCAICANHAN179.8°179.7°
HAGCAGCAICAN179.9°179.7°
HAGCAGCAIHAI0.1°0.0°
HAICAICANHAN0.2°0.0°
CAVCAWHAWHAWA118.7°120.0°
CAWCAVNBGHAV120.0°120.0°
CAWCAVNBGHAVA119.5°120.0°
CAWCAVHAVHAVA119.6°120.0°
CAWCAVNBGCAY114.6°90.1°
CAWCAVNBGCBD76.8°90.1°
HAWCAWCAVNBG78.6°60.0°
HAWCAWCAVHAV161.4°179.9°
HAWCAWCAVHAVA40.9°60.0°
HAWACAWCAVNBG42.8°60.0°
HAWACAWCAVHAV77.2°60.0°
HAWACAWCAVHAVA162.3°180.0°
NBGCAVHAVHAVA119.5°120.0°
CAVNBGCAYCBD168.9°179.9°
CAVNBGCBDCAS2.6°0.2°
CAVNBGCBDCAR174.6°180.0°
CAVNBGCAYCBE104.6°89.9°
CAVNBGCAYHAY15.4°150.0°
CAVNBGCAYHAYA137.4°30.1°
HAVCAVNBGCAY5.4°29.9°
HAVCAVNBGCBD163.2°149.9°
HAVACAVNBGCAY125.8°150.0°
HAVACAVNBGCBD42.7°29.9°
CAYNBGCBDCAS171.0°179.7°
CAYNBGCBDCAR6.3°0.1°
NBGCAYCBEHAY120.0°120.0°
NBGCAYCBEHAYA118.0°120.0°
NBGCAYHAYHAYA118.2°120.0°
NBGCAYCBENBI177.3°85.0°
NBGCAYCBECAT4.1°95.3°
NBGCBDCASCAR177.2°179.8°
NBGCBDCARCAO179.1°179.9°
NBGCBDCARHAR1.0°0.0°
NBGCBDCASCAP178.2°179.6°
NBGCBDCASHAS1.8°0.0°
CBDNBGCAYCBE86.5°89.9°
CBDNBGCAYHAY153.5°30.1°
CBDNBGCAYHAYA31.6°150.0°
CASCBDCARCAO1.8°0.3°
CASCBDCARHAR178.2°179.7°
CBDCASCAPCBB0.2°0.6°
CBDCASCAPHAS180.0°179.7°
CBDCASCAPHAP179.8°179.7°
CBDCARCAOHAR180.0°180.0°
CBDCARCAOCBB1.9°0.0°
CBDCARCAOHAO178.1°180.0°
CARCBDCASCAP1.0°0.6°
CARCBDCASHAS179.0°179.7°
CARCAOCBBHAO180.0°180.0°
CARCAOCBBCAP1.1°0.0°
CARCAOCBBCAF179.7°179.9°
HARCARCAOCBB178.2°180.0°
HARCARCAOHAO1.8°0.1°
CAOCBBCAPCAF178.6°179.9°
CAOCBBCAFNAC165.4°94.0°
CAOCBBCAPCAS0.3°0.3°
CAOCBBCAPHAP179.7°180.0°
HAOCAOCBBCAP178.9°180.0°
HAOCAOCBBCAF0.3°0.1°
CAPCBBCAFNAC13.2°86.1°
CBBCAPCASHAP180.0°179.7°
CBBCAPCASHAS179.8°179.7°
CAFCBBCAPCAS178.9°179.6°
CAFCBBCAPHAP1.1°0.1°
HAPCAPCASHAS0.2°0.0°
CBECAYHAYHAYA118.1°120.0°
CAYCBENBICAT178.9°179.7°
CAYCBECATNAZ179.9°180.0°
CAYCBECATHAT0.1°0.0°
CAYCBENBICAU180.0°179.8°
CAYCBENBICAB0.4°0.0°
HAYCAYCBENBI57.3°155.0°
HAYCAYCBECAT124.1°24.7°
HAYACAYCBENBI64.7°35.0°
HAYACAYCBECAT114.0°144.6°
NBICBECATNAZ1.1°0.3°
NBICBECATHAT178.9°179.8°
CBENBICAUNAZ0.6°0.4°
CBENBICAUCAB179.6°179.9°
CBENBICAUHAU179.4°179.8°
CBENBICABHAB24.5°90.0°
CBENBICABHABA95.5°150.0°
CBENBICABHABB144.5°30.0°
CBECATNAZHAT180.0°180.0°
CBECATNAZCAU0.7°0.0°
CATCBENBICAU1.1°0.4°
CATCBENBICAB179.3°179.7°
CATNAZCAUNBI0.1°0.2°
CATNAZCAUHAU179.9°180.0°
HATCATNAZCAU179.3°180.0°
NAZCAUNBIHAU180.0°179.8°
NAZCAUNBICAB179.8°179.7°
CAUNBICABHAB155.0°89.9°
CAUNBICABHABA84.9°30.2°
CAUNBICABHABB35.1°150.2°
HAUCAUNBICAB0.2°0.1°
NBICABHABHABA120.0°120.0°
NBICABHABHABB120.0°120.0°
NBICABHABAHABB120.0°120.0°
HABCABHABAHABB120.0°120.0°

223532

PDB entries from 2024-08-07

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