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9ZJ

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
CLCAOsing1.74Å1.73Å
CAOCAHdoub1.38Å1.39ÅAromatic
CAOCAJsing1.38Å1.39ÅAromatic
CAHCAIsing1.38Å1.39ÅAromatic
CAJCAQdoub1.38Å1.39ÅAromatic
FACCATsing1.40Å1.33Å
CAICAPdoub1.39Å1.39ÅAromatic
CAQCAPsing1.39Å1.39ÅAromatic
CAQCAUsing1.51Å1.39Å
CAPNAMsing1.40Å1.40Å
CATFABsing1.40Å1.33Å
CATFADsing1.40Å1.33Å
CATCAUsing1.53Å1.53Å
CAUOANsing1.43Å1.38Å
CAUCAGsing1.47Å1.47Å
NAMCARsing1.47Å1.43Å
CAROANsing1.43Å1.42Å
CARCAAsing1.53Å1.48Å
CAGCAFtrip1.17Å1.22Å
CAFCASsing1.47Å1.47Å
CAKCASsing1.53Å1.52Å
CAKCALsing1.53Å1.52Å
CASCALsing1.53Å1.52Å
CAKH1sing1.09Å1.10Å
CAKH2sing1.09Å1.10Å
CALH3sing1.09Å1.10Å
CALH4sing1.09Å1.10Å
CASH5sing1.09Å1.10Å
CARH6sing1.09Å1.10Å
CAAH7sing1.09Å1.10Å
CAAH8sing1.09Å1.10Å
CAAH9sing1.09Å1.10Å
NAMH10sing0.97Å1.00Å
CAJH11sing1.08Å1.08Å
CAHH12sing1.08Å1.08Å
CAIH13sing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
CLCAOCAH119.9°119.9°
CLCAOCAJ119.9°119.9°
CAHCAOCAJ120.1°120.2°
CAOCAHCAI120.0°119.9°
CAOCAHH12120.0°120.0°
CAOCAJCAQ119.8°120.1°
CAOCAJH11120.1°120.0°
CAHCAICAP119.8°119.9°
CAICAHH12120.0°120.0°
CAHCAIH13120.1°120.1°
CAJCAQCAP120.1°119.6°
CAJCAQCAU120.3°119.8°
CAQCAJH11120.1°119.9°
FACCATFAB109.4°109.5°
FACCATFAD109.4°109.4°
FACCATCAU109.5°109.5°
CAICAPCAQ120.2°120.3°
CAICAPNAM120.6°120.2°
CAPCAIH13120.1°120.1°
CAPCAQCAU119.6°120.6°
CAQCAPNAM119.2°119.6°
CAQCAUCAT109.4°109.2°
CAQCAUOAN120.4°110.2°
CAQCAUCAG109.4°109.3°
CAPNAMCAR120.4°117.9°
CAPNAMH10106.7°121.1°
FABCATFAD109.5°109.5°
FABCATCAU109.5°109.5°
FADCATCAU109.5°109.4°
CATCAUOAN121.6°109.4°
CATCAUCAG109.5°109.3°
OANCAUCAG81.9°109.3°
CAUOANCAR121.3°113.7°
CAUCAGCAF180.0°180.0°
NAMCAROAN113.7°107.9°
NAMCARCAA120.2°109.8°
NAMCARH697.1°109.8°
CARNAMH10106.7°121.0°
OANCARCAA121.6°109.7°
OANCARH697.2°109.8°
CAACARH696.9°109.8°
CARCAAH7109.5°109.5°
CARCAAH8109.5°109.5°
CARCAAH9109.5°109.5°
CAGCAFCAS180.0°180.0°
CAFCASCAK115.0°117.5°
CAFCASCAL115.0°117.5°
CAFCASH5118.6°115.5°
CASCAKCAL59.9°60.0°
CAKCASCAL60.0°60.0°
CASCAKH1120.0°117.5°
CASCAKH2120.0°117.5°
CAKCASH5117.5°117.5°
CAKCALCAS60.0°60.0°
CALCAKH1120.0°117.5°
CALCAKH2120.0°117.5°
CAKCALH3120.0°117.5°
CAKCALH4120.0°117.5°
CASCALH3120.0°117.5°
CASCALH4120.0°117.5°
CALCASH5117.5°117.5°
H1CAKH2109.5°115.6°
H3CALH4109.5°115.5°
H7CAAH8109.4°109.4°
H7CAAH9109.5°109.5°
H8CAAH9109.5°109.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
CLCAOCAHCAJ180.0°180.0°
CLCAOCAHCAI180.0°179.9°
CLCAOCAJCAQ179.9°180.0°
CLCAOCAJH110.1°0.0°
CLCAOCAHH120.0°0.1°
CAOCAHCAIH12180.0°180.0°
CAHCAOCAJCAQ0.0°0.0°
CAOCAHCAICAP0.1°0.1°
CAHCAOCAJH11180.0°180.0°
CAOCAHCAIH13179.9°180.0°
CAJCAOCAHCAI0.1°0.1°
CAOCAJCAQH11180.0°179.9°
CAOCAJCAQCAP0.1°0.1°
CAOCAJCAQCAU180.0°179.8°
CAJCAOCAHH12179.9°179.9°
CAHCAICAPH13180.0°179.9°
CAHCAICAPCAQ0.0°0.1°
CAHCAICAPNAM180.0°179.9°
CAJCAQCAPCAI0.0°0.1°
CAJCAQCAPCAU179.9°179.9°
CAJCAQCAPNAM179.9°179.9°
CAJCAQCAUCAT25.1°41.2°
CAJCAQCAUOAN173.3°161.4°
CAJCAQCAUCAG94.8°78.4°
FACCATCAUCAQ27.0°65.8°
FACCATFABFAD119.9°120.0°
FACCATFABCAU120.0°120.0°
FACCATFADCAU120.0°120.0°
FACCATCAUOAN120.7°173.5°
FACCATCAUCAG146.9°53.8°
CAICAPCAQNAM180.0°180.0°
CAICAPCAQCAU180.0°179.8°
CAICAPNAMCAR162.1°167.0°
CAICAPNAMH1040.5°13.0°
CAPCAICAHH12179.9°180.0°
CAPCAQCAUCAT154.9°138.9°
CAPCAQCAUOAN6.7°18.7°
CAPCAQCAUCAG85.2°101.5°
CAQCAPNAMCAR17.9°13.0°
CAQCAPNAMH10139.4°167.0°
CAPCAQCAJH11179.9°179.9°
CAQCAPCAIH13180.0°179.8°
CAUCAQCAPNAM0.0°0.3°
CAQCAUCATFAB92.9°174.1°
CAQCAUCATFAD147.0°54.1°
CAQCAUCATOAN147.7°120.7°
CAQCAUCATCAG119.8°119.6°
CAQCAUOANCAG107.8°120.2°
CAQCAUOANCAR4.5°51.6°
CAQCAUCAGCAF136.2°61.2°
CAUCAQCAJH110.0°0.3°
CAPNAMCARH10121.5°180.0°
CAPNAMCAROAN27.5°42.8°
CAPNAMCARCAA175.9°76.7°
CAPNAMCARH673.6°162.5°
NAMCAPCAIH130.0°0.2°
FABCATFADCAU120.1°120.0°
FABCATCAUOAN119.3°53.4°
FABCATCAUCAG26.9°66.3°
FADCATCAUOAN0.8°66.6°
FADCATCAUCAG93.2°173.7°
CATCAUOANCAG107.9°119.7°
CATCAUOANCAR139.8°171.8°
CATCAUCAGCAF103.9°179.2°
CAUOANCARNAM20.8°63.9°
CAUOANCARCAA177.1°55.7°
OANCAUCAGCAF16.8°59.5°
CAUOANCARH680.3°176.5°
CAGCAUOANCAR112.3°68.6°
CAUCAGCAFCAS27.0°NaN°
NAMCAROANCAA156.2°119.6°
NAMCAROANH6101.1°119.7°
NAMCARCAAH6102.4°120.8°
NAMCARCAAH7180.0°167.4°
NAMCARCAAH860.0°72.6°
NAMCARCAAH960.0°47.4°
OANCARCAAH6102.9°120.7°
OANCARCAAH725.3°49.0°
OANCARCAAH8145.3°169.0°
OANCARCAAH994.7°71.1°
OANCARNAMH10149.0°137.2°
CARCAAH7H8120.0°120.0°
CARCAAH7H9120.0°120.1°
CARCAAH8H9120.0°120.1°
CAACARNAMH1054.4°103.3°
CAGCAFCASCAK157.0°61.2°
CAGCAFCASCAL90.0°7.4°
CAGCAFCASH556.6°153.1°
CAFCASCAKCAL105.7°107.5°
CAFCASCAKH5146.8°145.0°
CAFCASCALH5146.9°145.0°
CAFCASCAKH13.8°145.0°
CAFCASCAKH2144.8°0.1°
CAFCASCALH33.9°0.0°
CAFCASCALH4144.9°145.0°
CASCAKCALH1109.4°107.5°
CASCAKCALH2109.5°107.5°
CAKCASCALH5107.5°107.5°
CASCAKH1H2144.8°145.8°
CASCAKCALH3109.5°107.5°
CASCAKCALH4109.5°107.5°
CALCAKH1H2144.8°145.7°
CAKCALH3H4144.7°145.7°
CASCALH3H4144.7°145.7°
H1CAKCALH30.1°145.0°
H1CAKCALH4141.1°0.0°
H1CAKCASH5143.1°0.0°
H2CAKCALH3141.0°0.0°
H2CAKCALH40.0°145.0°
H2CAKCASH52.0°145.1°
H3CALCASH5143.1°145.0°
H4CALCASH52.0°0.0°
H6CARCAAH777.6°71.8°
H6CARCAAH842.4°48.2°
H6CARCAAH9162.4°168.2°
H6CARNAMH1047.9°17.5°
H7CAAH8H9120.0°119.9°
H12CAHCAIH130.1°0.1°

222624

PDB entries from 2024-07-17

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