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G4T

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
CLCBIsing1.74Å1.72Å
CAFCAAsing1.53Å1.53Å
CAFCBFsing1.51Å1.53Å
NBCCBMsing1.40Å1.34Å
NBCCBFsing1.35Å1.35Å
CBICBMdoub1.39Å1.39ÅAromatic
CBICAOsing1.38Å1.39ÅAromatic
CBMCATsing1.39Å1.39ÅAromatic
CBFOABdoub1.21Å1.23Å
CAOCAPdoub1.38Å1.39ÅAromatic
CATCBJdoub1.39Å1.39ÅAromatic
CAPCBJsing1.39Å1.39ÅAromatic
CBJNBBsing1.40Å1.34Å
NBBCBGsing1.35Å1.35Å
CBGOACdoub1.22Å1.23Å
CBGNBDsing1.35Å1.34Å
NBDCBSsing1.46Å1.46Å
CAVCBSsing1.53Å1.52Å
CAVCAXsing1.53Å1.52Å
CBSCAWsing1.53Å1.52Å
CAXNBTsing1.47Å1.47Å
CAWCAYsing1.53Å1.52Å
NBTCAYsing1.47Å1.47Å
NBTCAZsing1.47Å1.47Å
CAZCBHsing1.51Å1.39Å
CAMCBHdoub1.38Å1.39ÅAromatic
CAMCAQsing1.38Å1.39ÅAromatic
CBHCANsing1.38Å1.39ÅAromatic
CAQCBLdoub1.39Å1.39ÅAromatic
CANCARdoub1.38Å1.39ÅAromatic
CBLCARsing1.40Å1.39ÅAromatic
CBLCBOsing1.48Å1.40Å
CAKCAHdoub1.38Å1.39ÅAromatic
CAKCBKsing1.39Å1.39ÅAromatic
CAHCAGsing1.38Å1.39ÅAromatic
CBONBAdoub1.32Å1.34ÅAromatic
CBOCBNsing1.41Å1.41ÅAromatic
NBACBQsing1.33Å1.34ÅAromatic
CBNCBKsing1.48Å1.39Å
CBNCAUdoub1.39Å1.39ÅAromatic
CBKCALdoub1.39Å1.39ÅAromatic
CBQCASsing1.46Å1.39Å
CBQCBRdoub1.42Å1.39ÅAromatic
CASCAJdoub1.34Å1.39Å
CAGCAIdoub1.38Å1.39ÅAromatic
CAUCBRsing1.39Å1.39ÅAromatic
CBRCBPsing1.47Å1.39Å
CAJNBEsing1.36Å1.32Å
CALCAIsing1.38Å1.39ÅAromatic
NBECBPsing1.35Å1.40Å
CBPOADdoub1.22Å1.23Å
CAKH1sing1.08Å1.08Å
CAHH2sing1.08Å1.08Å
CAGH3sing1.08Å1.08Å
CAIH4sing1.08Å1.08Å
CALH5sing1.08Å1.08Å
CAUH6sing1.08Å1.08Å
CAJH7sing1.08Å1.08Å
CASH8sing1.08Å1.08Å
CARH10sing1.08Å1.08Å
CANH11sing1.08Å1.08Å
CAQH12sing1.08Å1.08Å
CAMH13sing1.08Å1.08Å
CAZH14sing1.09Å1.10Å
CAZH15sing1.09Å1.10Å
CAYH17sing1.09Å1.10Å
CAYH18sing1.09Å1.10Å
CAWH19sing1.09Å1.10Å
CAWH20sing1.09Å1.10Å
CAXH21sing1.09Å1.10Å
CAXH22sing1.09Å1.10Å
CAVH23sing1.09Å1.10Å
CAVH24sing1.09Å1.10Å
CBSH25sing1.09Å1.10Å
NBDH26sing0.97Å1.00Å
NBBH27sing0.97Å1.00Å
CATH28sing1.08Å1.08Å
CAPH29sing1.08Å1.08Å
CAOH30sing1.08Å1.08Å
NBCH31sing0.97Å1.00Å
CAFH32sing1.09Å1.10Å
CAFH33sing1.09Å1.10Å
CAAH34sing1.09Å1.10Å
CAAH35sing1.09Å1.10Å
CAAH36sing1.09Å1.10Å
NBEH37sing0.97Å1.00Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
CLCBICBM121.2°120.0°
CLCBICAO119.5°120.0°
CAACAFCBF115.7°109.4°
CAACAFH32107.9°109.5°
CAACAFH33107.9°109.5°
CAFCAAH34109.5°109.5°
CAFCAAH35109.5°109.5°
CAFCAAH36109.5°109.4°
CAFCBFNBC114.8°120.0°
CAFCBFOAB120.3°120.0°
CBFCAFH32107.9°109.5°
CBFCAFH33107.9°109.5°
CBMNBCCBF119.4°120.0°
NBCCBMCBI117.0°120.1°
NBCCBMCAT122.6°120.0°
CBMNBCH31120.3°120.0°
NBCCBFOAB124.9°120.0°
CBFNBCH31120.3°120.0°
CBMCBICAO119.4°120.0°
CBICBMCAT120.4°119.9°
CBICAOCAP120.4°120.2°
CBICAOH30119.8°119.9°
CBMCATCBJ120.2°119.9°
CBMCATH28119.9°120.1°
CAOCAPCBJ120.3°120.1°
CAOCAPH29119.8°120.0°
CAPCAOH30119.8°119.9°
CATCBJCAP119.4°120.0°
CATCBJNBB122.1°120.0°
CBJCATH28119.9°120.0°
CAPCBJNBB118.5°120.0°
CBJCAPH29119.8°120.0°
CBJNBBCBG121.2°120.0°
CBJNBBH27119.4°120.0°
NBBCBGOAC123.4°120.0°
NBBCBGNBD116.2°120.0°
CBGNBBH27119.4°120.0°
OACCBGNBD120.4°120.0°
CBGNBDCBS121.7°120.0°
CBGNBDH26119.1°120.0°
NBDCBSCAV107.6°109.5°
NBDCBSCAW110.4°109.5°
NBDCBSH25110.2°109.6°
CBSNBDH26119.2°120.1°
CBSCAVCAX109.0°109.3°
CAVCBSCAW109.7°109.1°
CBSCAVH23109.6°109.5°
CBSCAVH24109.6°109.5°
CAVCBSH25109.5°109.5°
CAVCAXNBT110.7°109.5°
CAVCAXH21109.2°109.5°
CAVCAXH22109.2°109.4°
CAXCAVH23109.6°109.5°
CAXCAVH24109.6°109.5°
CBSCAWCAY108.6°109.3°
CBSCAWH19109.7°109.5°
CBSCAWH20109.7°109.5°
CAWCBSH25109.4°109.5°
CAXNBTCAY109.2°111.2°
CAXNBTCAZ108.4°111.0°
NBTCAXH21109.2°109.5°
NBTCAXH22109.2°109.4°
CAWCAYNBT110.9°109.5°
CAWCAYH17109.1°109.5°
CAWCAYH18109.1°109.5°
CAYCAWH19109.7°109.5°
CAYCAWH20109.7°109.5°
CAYNBTCAZ110.9°111.0°
NBTCAYH17109.1°109.5°
NBTCAYH18109.1°109.5°
NBTCAZCBH112.7°109.5°
NBTCAZH14108.6°109.5°
NBTCAZH15108.6°109.5°
CAZCBHCAM121.1°119.9°
CAZCBHCAN119.4°119.9°
CBHCAZH14108.7°109.5°
CBHCAZH15108.6°109.4°
CBHCAMCAQ120.3°120.1°
CAMCBHCAN119.5°120.2°
CBHCAMH13119.9°119.9°
CAMCAQCBL120.3°119.9°
CAMCAQH12119.8°120.1°
CAQCAMH13119.9°119.9°
CBHCANCAR120.3°120.2°
CBHCANH11119.8°119.9°
CAQCBLCAR119.2°119.7°
CAQCBLCBO119.7°120.2°
CBLCAQH12119.9°120.0°
CANCARCBL120.4°119.8°
CANCARH10119.8°120.1°
CARCANH11119.9°119.9°
CARCBLCBO121.1°120.1°
CBLCARH10119.8°120.1°
CBLCBONBA116.3°119.4°
CBLCBOCBN124.3°119.4°
CAHCAKCBK120.1°119.9°
CAKCAHCAG120.0°120.1°
CAHCAKH1119.9°120.1°
CAKCAHH2120.0°120.0°
CAKCBKCBN121.6°120.2°
CAKCBKCAL119.8°119.8°
CBKCAKH1120.0°120.1°
CAHCAGCAI119.9°120.3°
CAGCAHH2120.0°119.9°
CAHCAGH3120.0°119.9°
NBACBOCBN119.4°121.2°
CBONBACBQ122.1°121.4°
CBOCBNCBK124.4°120.3°
CBOCBNCAU119.1°119.4°
NBACBQCAS120.2°121.5°
NBACBQCBR120.5°120.5°
CBKCBNCAU116.5°120.3°
CBNCBKCAL118.6°120.1°
CBNCAUCBR119.7°118.0°
CBNCAUH6120.2°121.0°
CBKCALCAI120.2°119.8°
CBKCALH5119.9°120.1°
CASCBQCBR119.3°118.0°
CBQCASCAJ119.9°119.5°
CBQCASH8120.0°120.2°
CBQCBRCAU119.2°119.6°
CBQCBRCBP119.7°118.5°
CASCAJNBE121.0°122.5°
CASCAJH7119.5°118.7°
CAJCASH8120.0°120.2°
CAGCAICAL120.0°120.1°
CAICAGH3120.1°119.8°
CAGCAIH4120.0°120.0°
CAUCBRCBP121.2°121.9°
CBRCAUH6120.2°121.0°
CBRCBPNBE119.4°119.2°
CBRCBPOAD120.9°120.4°
CAJNBECBP120.7°122.2°
NBECAJH7119.5°118.8°
CAJNBEH37119.6°119.0°
CALCAIH4120.0°119.9°
CAICALH5119.9°120.0°
NBECBPOAD119.7°120.4°
CBPNBEH37119.7°118.9°
H14CAZH15109.5°109.4°
H17CAYH18109.5°109.5°
H19CAWH20109.5°109.5°
H21CAXH22109.4°109.4°
H23CAVH24109.4°109.5°
H32CAFH33109.4°109.5°
H34CAAH35109.5°109.5°
H34CAAH36109.5°109.4°
H35CAAH36109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
CLCBICBMNBC0.7°0.3°
CLCBICBMCAO179.6°179.7°
CLCBICBMCAT179.4°180.0°
CLCBICAOCAP180.0°180.0°
CLCBICAOH300.0°0.0°
CAACAFCBFH32120.9°120.0°
CAACAFCBFH33120.9°120.0°
CAACAFCBFNBC179.5°180.0°
CAACAFCBFOAB0.4°0.1°
CAACAFH32H33117.2°120.0°
CAFCAAH34H35120.0°120.1°
CAFCAAH34H36120.0°119.9°
CAFCAAH35H36120.0°120.0°
CAFCBFNBCCBM179.4°175.4°
CAFCBFNBCOAB179.1°179.9°
CAFCBFNBCH310.6°4.5°
CBFCAFH32H33117.1°120.0°
CBFCAFCAAH34180.0°60.1°
CBFCAFCAAH3560.0°60.0°
CBFCAFCAAH3660.0°180.0°
CBMNBCCBFH31180.0°180.0°
NBCCBMCBICAT178.7°179.7°
NBCCBMCBICAO179.7°180.0°
CBMNBCCBFOAB1.5°4.7°
NBCCBMCATCBJ179.6°179.7°
NBCCBMCATH280.4°0.3°
CBFNBCCBMCBI123.1°147.5°
CBFNBCCBMCAT58.3°32.8°
NBCCBFCAFH3258.6°60.0°
NBCCBFCAFH3359.5°59.9°
CBMCBICAOCAP0.4°0.3°
CBICBMCATCBJ1.8°0.0°
CBICBMCATH28178.2°180.0°
CBMCBICAOH30179.6°179.7°
CBICBMNBCH3156.9°32.4°
CAOCBICBMCAT1.0°0.3°
CBICAOCAPH30180.0°180.0°
CBICAOCAPCBJ0.5°0.0°
CBICAOCAPH29179.5°180.0°
CBMCATCBJH28180.0°179.9°
CBMCATCBJCAP1.9°0.3°
CBMCATCBJNBB180.0°180.0°
CATCBMNBCH31121.7°147.3°
OABCBFNBCH31178.5°175.4°
OABCBFCAFH32120.5°120.0°
OABCBFCAFH33121.3°120.0°
CAOCAPCBJCAT1.2°0.3°
CAOCAPCBJH29180.0°180.0°
CAOCAPCBJNBB179.4°180.0°
CATCBJCAPNBB178.1°179.6°
CATCBJNBBCBG49.3°146.3°
CATCBJNBBH27130.7°33.6°
CATCBJCAPH29178.8°179.7°
CAPCBJNBBCBG132.6°34.0°
CAPCBJNBBH2747.4°146.1°
CAPCBJCATH28178.1°179.7°
CBJCAPCAOH30179.5°180.0°
CBJNBBCBGH27180.0°179.9°
CBJNBBCBGOAC0.8°5.1°
CBJNBBCBGNBD179.7°174.9°
NBBCBJCATH280.0°0.1°
NBBCBJCAPH290.6°0.0°
NBBCBGOACNBD178.8°180.0°
NBBCBGNBDCBS179.0°180.0°
NBBCBGNBDH261.1°0.0°
OACCBGNBDCBS2.1°0.0°
OACCBGNBDH26177.9°179.9°
OACCBGNBBH27179.2°174.8°
CBGNBDCBSH26180.0°180.0°
CBGNBDCBSCAV106.7°155.0°
CBGNBDCBSCAW133.6°85.3°
CBGNBDCBSH2512.6°34.8°
NBDCBGNBBH270.3°5.2°
NBDCBSCAVCAW120.2°119.9°
NBDCBSCAVH25119.8°120.2°
NBDCBSCAVCAX177.4°177.6°
NBDCBSCAWH25121.4°120.2°
NBDCBSCAWCAY175.7°177.6°
NBDCBSCAWH1964.4°57.6°
NBDCBSCAWH2055.8°62.5°
NBDCBSCAVH2357.5°62.5°
NBDCBSCAVH2462.6°57.6°
CBSCAVCAXH23120.0°120.0°
CBSCAVCAXH24120.0°120.0°
CAVCBSCAWH25120.1°119.9°
CBSCAVCAXNBT59.5°59.2°
CAVCBSCAWCAY57.2°57.7°
CAVCBSCAWH19177.1°62.3°
CAVCBSCAWH2062.6°177.6°
CBSCAVCAXH21179.7°60.8°
CBSCAVCAXH2260.7°179.2°
CBSCAVH23H24120.2°120.1°
CAVCBSNBDH2673.4°25.0°
CAXCAVCBSCAW57.3°57.7°
CAVCAXNBTH21120.2°120.1°
CAVCAXNBTH22120.2°120.0°
CAVCAXNBTCAY61.3°61.8°
CAVCAXNBTCAZ177.8°174.1°
CAVCAXH21H22119.4°120.0°
CAXCAVH23H24120.2°120.0°
CAXCAVCBSH2562.8°62.2°
CBSCAWCAYH19119.9°120.0°
CBSCAWCAYH20119.9°119.9°
CBSCAWCAYNBT59.7°59.2°
CBSCAWCAYH1760.5°179.2°
CBSCAWCAYH18179.9°60.8°
CBSCAWH19H20120.4°120.1°
CAWCBSCAVH2362.7°177.6°
CAWCBSCAVH24177.2°62.3°
CAWCBSNBDH2646.4°94.7°
CAXNBTCAYCAW61.6°61.8°
CAXNBTCAYCAZ119.5°124.1°
CAXNBTCAZCBH166.7°65.8°
CAXNBTCAZH1446.2°174.2°
CAXNBTCAZH1572.9°54.2°
CAXNBTCAYH1758.6°178.2°
CAXNBTCAYH18178.2°58.2°
NBTCAXH21H22119.4°120.0°
NBTCAXCAVH2360.5°179.2°
NBTCAXCAVH24179.4°60.8°
CAWCAYNBTH17120.2°120.0°
CAWCAYNBTH18120.2°120.0°
CAWCAYNBTCAZ178.9°174.1°
CAWCAYH17H18119.3°120.0°
CAYCAWH19H20120.4°120.0°
CAYCAWCBSH2562.9°62.2°
CAYNBTCAZCBH73.4°170.0°
CAYNBTCAZH14166.1°49.9°
CAYNBTCAZH1547.0°70.0°
NBTCAYH17H18119.4°120.0°
NBTCAYCAWH19179.6°60.8°
NBTCAYCAWH2060.2°179.1°
CAYNBTCAXH21178.5°58.3°
CAYNBTCAXH2258.9°178.3°
NBTCAZCBHH14120.5°120.1°
NBTCAZCBHH15120.5°120.0°
NBTCAZCBHCAM47.7°90.0°
NBTCAZCBHCAN132.4°90.7°
NBTCAZH14H15118.5°120.0°
CAZNBTCAYH1760.9°54.1°
CAZNBTCAYH1858.7°65.9°
CAZNBTCAXH2157.6°65.8°
CAZNBTCAXH2262.0°54.2°
CAZCBHCAMCAN179.9°179.3°
CAZCBHCAMCAQ180.0°179.9°
CAZCBHCANCAR179.9°179.8°
CAZCBHCANH110.1°0.2°
CAZCBHCAMH130.0°0.7°
CBHCAZH14H15118.5°119.9°
CBHCAMCAQH13180.0°179.2°
CBHCAMCAQCBL0.7°0.5°
CAMCBHCANCAR0.2°0.4°
CAMCBHCANH11179.8°179.5°
CBHCAMCAQH12179.3°179.5°
CAMCBHCAZH1472.8°150.0°
CAMCBHCAZH15168.2°30.1°
CAQCAMCBHCAN0.1°0.8°
CAMCAQCBLH12180.0°179.9°
CAMCAQCBLCAR1.3°0.0°
CAMCAQCBLCBO179.3°179.7°
CBHCANCARH11180.0°179.9°
CBHCANCARCBL0.8°0.1°
CBHCANCARH10179.2°180.0°
CANCBHCAMH13179.9°179.9°
CANCBHCAZH14107.1°29.4°
CANCBHCAZH1511.9°149.3°
CAQCBLCARCAN1.3°0.3°
CAQCBLCARCBO178.0°179.7°
CAQCBLCBONBA54.3°144.7°
CAQCBLCBOCBN126.3°35.8°
CAQCBLCARH10178.6°179.8°
CBLCAQCAMH13179.3°179.7°
CANCARCBLH10180.0°179.9°
CANCARCBLCBO179.4°180.0°
CARCBLCBONBA123.7°35.0°
CARCBLCBOCBN55.7°144.5°
CBLCARCANH11179.2°180.0°
CARCBLCAQH12178.7°180.0°
CBLCBONBACBN179.5°179.5°
CBLCBONBACBQ179.7°180.0°
CBLCBOCBNCBK0.7°0.3°
CBLCBOCBNCAU179.5°180.0°
CBOCBLCARH100.6°0.1°
CBOCBLCAQH120.7°0.3°
CAHCAKCBKH1180.0°179.7°
CAKCAHCAGH2180.0°180.0°
CAHCAKCBKCBN179.5°180.0°
CAHCAKCBKCAL1.2°0.0°
CAKCAHCAGCAI0.0°0.0°
CAKCAHCAGH3180.0°179.9°
CBKCAKCAHCAG0.6°0.0°
CAKCBKCBNCBO55.1°129.7°
CAKCBKCBNCAL178.4°180.0°
CAKCBKCBNCAU124.7°50.0°
CAKCBKCALCAI1.2°0.0°
CBKCAKCAHH2179.4°180.0°
CAKCBKCALH5178.8°180.0°
CAHCAGCAIH3180.0°179.9°
CAHCAGCAICAL0.0°0.0°
CAGCAHCAKH1179.4°179.7°
CAHCAGCAIH4180.0°180.0°
NBACBOCBNCBK179.9°179.8°
NBACBOCBNCAU0.1°0.6°
CBONBACBQCAS180.0°179.8°
CBONBACBQCBR0.2°0.2°
CBNCBONBACBQ0.2°0.5°
CBOCBNCBKCAU179.8°179.7°
CBOCBNCBKCAL126.5°50.3°
CBOCBNCAUCBR0.1°0.3°
CBOCBNCAUH6179.9°179.8°
NBACBQCASCBR179.8°180.0°
NBACBQCASCAJ180.0°180.0°
NBACBQCBRCAU0.0°0.0°
NBACBQCBRCBP179.9°180.0°
NBACBQCASH80.0°0.0°
CBKCBNCAUCBR179.7°180.0°
CBNCBKCALCAI179.6°180.0°
CBNCBKCAKH10.5°0.3°
CBNCBKCALH50.4°0.0°
CBKCBNCAUH60.2°0.1°
CAUCBNCBKCAL53.7°130.0°
CBNCAUCBRCBQ0.1°0.0°
CBNCAUCBRH6180.0°179.9°
CBNCAUCBRCBP180.0°179.9°
CBKCALCAICAG0.6°0.0°
CBKCALCAIH5180.0°180.0°
CALCBKCAKH1178.8°179.7°
CBKCALCAIH4179.4°180.0°
CBQCASCAJH8180.0°180.0°
CASCBQCBRCAU179.8°180.0°
CASCBQCBRCBP0.0°0.0°
CBQCASCAJNBE0.1°0.0°
CBQCASCAJH7179.9°180.0°
CBRCBQCASCAJ0.1°0.0°
CBQCBRCAUCBP179.8°180.0°
CBQCBRCBPNBE0.1°0.0°
CBQCBRCBPOAD179.9°180.0°
CBQCBRCAUH6179.9°180.0°
CBRCBQCASH8179.8°179.9°
CASCAJNBEH7180.0°180.0°
CASCAJNBECBP0.0°0.0°
CASCAJNBEH37180.0°180.0°
CAGCAICALH4180.0°180.0°
CAICAGCAHH2180.0°180.0°
CAGCAICALH5179.4°180.0°
CAUCBRCBPNBE180.0°180.0°
CAUCBRCBPOAD0.2°0.1°
CBRCBPNBECAJ0.1°0.0°
CBRCBPNBEOAD179.8°179.9°
CBPCBRCAUH60.0°0.0°
CBRCBPNBEH37179.8°180.0°
CAJNBECBPH37180.0°180.0°
CAJNBECBPOAD179.9°180.0°
NBECAJCASH8179.9°180.0°
CALCAICAGH3180.0°180.0°
CBPNBECAJH7180.0°180.0°
OADCBPNBEH370.0°0.0°
H1CAKCAHH20.6°0.3°
H2CAHCAGH30.0°0.0°
H3CAGCAIH40.1°0.1°
H4CAICALH50.5°0.0°
H7CAJCASH80.1°0.1°
H7CAJNBEH370.0°0.0°
H10CARCANH110.8°0.1°
H12CAQCAMH130.7°0.3°
H17CAYCAWH1959.3°59.2°
H17CAYCAWH20179.6°60.8°
H18CAYCAWH1960.2°179.2°
H18CAYCAWH2060.0°59.1°
H19CAWCBSH2557.0°177.8°
H20CAWCBSH25177.3°57.7°
H21CAXCAVH2359.7°59.1°
H21CAXCAVH2460.4°179.2°
H22CAXCAVH23179.3°60.9°
H22CAXCAVH2459.2°59.2°
H23CAVCBSH25177.3°57.7°
H24CAVCBSH2557.1°177.8°
H25CBSNBDH26167.3°145.1°
H29CAPCAOH300.5°0.0°
H32CAFCAAH3459.1°180.0°
H32CAFCAAH3560.9°60.0°
H32CAFCAAH36179.1°60.0°
H33CAFCAAH3459.1°59.9°
H33CAFCAAH35179.1°180.0°
H33CAFCAAH3660.9°60.0°
H34CAAH35H36120.0°120.0°

222415

PDB entries from 2024-07-10

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