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2V4

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
OAECAOsing1.36Å1.36Å
CAICAOdoub1.39Å1.39ÅAromatic
CAICAHsing1.38Å1.39ÅAromatic
CAOCAVsing1.40Å1.40ÅAromatic
CAHCAJdoub1.39Å1.39ÅAromatic
CAVCATsing1.48Å1.40Å
CAVCAUdoub1.41Å1.39ÅAromatic
OADCATdoub1.22Å1.24Å
CAJCAUsing1.39Å1.40ÅAromatic
CATCAWsing1.48Å1.40Å
CAUCASsing1.48Å1.40Å
OAFCAPsing1.35Å1.36Å
CAWCAPdoub1.40Å1.40ÅAromatic
CAWCAXsing1.40Å1.41ÅAromatic
CASOACdoub1.22Å1.23Å
CASCAXsing1.48Å1.41Å
CAPCAKsing1.39Å1.38ÅAromatic
CAXCARdoub1.40Å1.42ÅAromatic
CAKCAQdoub1.38Å1.39ÅAromatic
CARCAQsing1.40Å1.39ÅAromatic
CARCANsing1.48Å1.40Å
OABCANdoub1.21Å1.23Å
CAQCAMsing1.51Å1.40Å
CANCALsing1.51Å1.41Å
CAMCAYsing1.53Å1.54Å
CALCAYsing1.53Å1.56Å
CAYCAAsing1.53Å1.53Å
CAYOAGsing1.43Å1.43Å
CALH1sing1.09Å1.10Å
CALH2sing1.09Å1.10Å
CAAH3sing1.09Å1.10Å
CAAH4sing1.09Å1.10Å
CAAH5sing1.09Å1.10Å
OAGH6sing0.97Å0.95Å
CAMH7sing1.09Å1.10Å
CAMH8sing1.09Å1.10Å
CAKH9sing1.08Å1.08Å
OAFH10sing0.97Å0.95Å
CAJH11sing1.08Å1.08Å
CAHH12sing1.08Å1.08Å
CAIH13sing1.08Å1.08Å
OAEH14sing0.97Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
OAECAOCAI120.9°120.2°
OAECAOCAV117.3°120.2°
CAOOAEH14109.5°114.0°
CAOCAICAH119.5°120.5°
CAICAOCAV121.7°119.6°
CAOCAIH13120.3°119.8°
CAICAHCAJ119.4°120.6°
CAICAHH12120.3°119.7°
CAHCAIH13120.2°119.7°
CAOCAVCAT121.8°120.7°
CAOCAVCAU118.5°119.6°
CAHCAJCAU121.2°119.9°
CAHCAJH11119.4°120.0°
CAJCAHH12120.3°119.7°
CATCAVCAU119.7°119.7°
CAVCATOAD120.4°120.4°
CAVCATCAW119.6°119.3°
CAVCAUCAJ119.7°119.8°
CAVCAUCAS120.8°119.5°
OADCATCAW120.0°120.3°
CAJCAUCAS119.5°120.7°
CAUCAJH11119.4°120.1°
CATCAWCAP119.8°120.7°
CATCAWCAX120.9°119.8°
CAUCASOAC118.9°120.4°
CAUCASCAX120.2°119.1°
OAFCAPCAW117.7°120.0°
OAFCAPCAK120.6°120.0°
CAPOAFH10109.5°114.0°
CAPCAWCAX119.3°119.5°
CAWCAPCAK121.8°120.1°
CAWCAXCAS118.7°119.7°
CAWCAXCAR118.6°119.6°
OACCASCAX121.0°120.5°
CASCAXCAR122.6°120.7°
CAPCAKCAQ119.1°120.8°
CAPCAKH9120.5°119.6°
CAXCARCAQ120.1°120.2°
CAXCARCAN125.6°119.7°
CAKCAQCAR121.1°119.7°
CAKCAQCAM120.4°118.9°
CAQCAKH9120.4°119.6°
CAQCARCAN114.2°120.1°
CARCAQCAM118.6°121.4°
CARCANOAB122.1°121.2°
CARCANCAL117.9°117.7°
OABCANCAL119.9°121.1°
CAQCAMCAY110.0°111.3°
CAQCAMH7109.3°109.1°
CAQCAMH8109.3°109.0°
CANCALCAY111.6°107.4°
CANCALH1109.0°109.9°
CANCALH2108.9°109.9°
CAMCAYCAL110.6°109.4°
CAMCAYCAA109.4°109.5°
CAMCAYOAG108.8°109.5°
CAYCAMH7109.4°109.1°
CAYCAMH8109.3°109.1°
CALCAYCAA110.0°109.5°
CALCAYOAG109.6°109.5°
CAYCALH1108.9°109.8°
CAYCALH2108.9°109.8°
CAACAYOAG108.3°109.5°
CAYCAAH3109.5°109.5°
CAYCAAH4109.5°109.5°
CAYCAAH5109.5°109.5°
CAYOAGH6109.5°113.9°
H1CALH2109.5°109.9°
H3CAAH4109.5°109.5°
H3CAAH5109.5°109.5°
H4CAAH5109.5°109.4°
H7CAMH8109.5°109.1°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
OAECAOCAICAV180.0°179.6°
OAECAOCAICAH180.0°179.9°
OAECAOCAVCAT0.3°0.2°
OAECAOCAVCAU179.6°180.0°
OAECAOCAIH130.1°0.4°
CAOCAICAHH13180.0°179.6°
CAOCAICAHCAJ0.3°0.1°
CAICAOCAVCAT179.7°179.8°
CAICAOCAVCAU0.4°0.4°
CAOCAICAHH12179.7°179.8°
CAICAOOAEH14179.9°89.9°
CAHCAICAOCAV0.0°0.3°
CAICAHCAJH12180.0°179.9°
CAICAHCAJCAU0.1°0.0°
CAICAHCAJH11179.9°180.0°
CAOCAVCATCAU179.3°179.8°
CAOCAVCATOAD0.4°14.0°
CAOCAVCAUCAJ0.5°0.3°
CAOCAVCATCAW179.5°166.1°
CAOCAVCAUCAS179.9°180.0°
CAVCAOCAIH13179.9°180.0°
CAVCAOOAEH140.1°89.7°
CAHCAJCAUCAV0.3°0.1°
CAHCAJCAUH11180.0°180.0°
CAHCAJCAUCAS179.9°179.8°
CAJCAHCAIH13179.7°179.7°
CAVCATOADCAW179.9°180.0°
CATCAVCAUCAJ179.9°179.9°
CATCAVCAUCAS0.6°0.2°
CAVCATCAWCAP179.8°166.2°
CAVCATCAWCAX0.4°13.7°
CAUCAVCATOAD179.7°166.2°
CAVCAUCAJCAS179.5°179.7°
CAUCAVCATCAW0.2°13.7°
CAVCAUCASOAC179.3°166.2°
CAVCAUCASCAX0.4°14.1°
CAVCAUCAJH11179.7°179.9°
OADCATCAWCAP0.1°13.9°
OADCATCAWCAX179.7°166.3°
CAJCAUCASOAC0.3°13.6°
CAJCAUCASCAX179.9°166.2°
CAUCAJCAHH12179.9°180.0°
CATCAWCAPOAF0.8°0.3°
CATCAWCAPCAX179.8°179.8°
CATCAWCAXCAS0.7°0.3°
CATCAWCAPCAK179.1°179.6°
CATCAWCAXCAR180.0°179.7°
CAUCASCAXCAW0.3°14.2°
CAUCASOACCAX179.7°179.7°
CAUCASCAXCAR179.6°165.8°
CASCAUCAJH110.1°0.2°
OAFCAPCAWCAK179.9°180.0°
OAFCAPCAWCAX179.5°179.8°
OAFCAPCAKCAQ179.1°180.0°
OAFCAPCAKH90.9°0.0°
CAPCAWCAXCAS179.6°179.9°
CAPCAWCAXCAR0.2°0.1°
CAWCAPCAKCAQ1.0°0.0°
CAWCAPCAKH9179.0°180.0°
CAWCAPOAFH100.8°90.0°
CAWCAXCASOAC179.9°166.1°
CAWCAXCASCAR179.3°180.0°
CAXCAWCAPCAK0.6°0.2°
CAWCAXCARCAQ0.7°0.2°
CAWCAXCARCAN178.7°179.6°
OACCASCAXCAR0.8°13.9°
CASCAXCARCAQ180.0°179.8°
CASCAXCARCAN2.0°0.4°
CAPCAKCAQH9180.0°180.0°
CAPCAKCAQCAR0.6°0.3°
CAPCAKCAQCAM179.8°179.6°
CAKCAPOAFH10179.2°90.0°
CAXCARCAQCAK0.3°0.4°
CAXCARCAQCAN178.3°179.8°
CAXCARCANOAB54.6°11.4°
CAXCARCAQCAM179.0°179.5°
CAXCARCANCAL129.3°168.6°
CAKCAQCARCAM179.2°179.9°
CAKCAQCARCAN178.5°179.4°
CAKCAQCAMCAY131.1°157.3°
CAKCAQCAMH711.0°36.9°
CAKCAQCAMH8108.8°82.2°
CAQCARCANOAB127.3°168.5°
CAQCARCANCAL48.8°11.5°
CARCAQCAMCAY48.1°22.7°
CARCAQCAMH7168.2°143.2°
CARCAQCAMH872.0°97.7°
CARCAQCAKH9179.4°179.7°
CARCANOABCAL176.0°180.0°
CANCARCAQCAM0.7°0.6°
CARCANCALCAY42.2°42.6°
CARCANCALH1162.5°162.1°
CARCANCALH278.1°76.8°
OABCANCALCAY133.9°137.4°
OABCANCALH113.6°17.9°
OABCANCALH2105.8°103.2°
CAQCAMCAYH7120.1°120.5°
CAQCAMCAYH8120.1°120.4°
CAQCAMCAYCAL49.6°54.7°
CAQCAMCAYCAA71.8°174.7°
CAQCAMCAYOAG170.1°65.3°
CAQCAMH7H8119.7°119.0°
CAMCAQCAKH90.2°0.4°
CANCALCAYCAM6.9°64.0°
CANCALCAYH1120.3°119.5°
CANCALCAYH2120.3°119.4°
CANCALCAYCAA114.1°176.0°
CANCALCAYOAG126.9°55.9°
CANCALH1H2119.0°121.1°
CAMCAYCALCAA121.0°120.0°
CAMCAYCALOAG119.9°119.9°
CAMCAYCAAOAG118.4°120.0°
CAMCAYCALH1113.4°176.5°
CAMCAYCALH2127.3°55.4°
CAMCAYCAAH3180.0°59.9°
CAMCAYCAAH460.0°60.2°
CAMCAYCAAH560.0°179.9°
CAMCAYOAGH6180.0°179.9°
CAYCAMH7H8119.8°119.1°
CALCAYCAAOAG119.8°120.1°
CAYCALH1H2119.0°121.0°
CALCAYCAAH358.3°60.0°
CALCAYCAAH461.7°180.0°
CALCAYCAAH5178.3°60.0°
CALCAYOAGH658.9°60.0°
CALCAYCAMH7169.7°175.1°
CALCAYCAMH870.5°65.7°
CAACAYCALH1125.6°56.5°
CAACAYCALH26.2°64.5°
CAYCAAH3H4120.0°120.0°
CAYCAAH3H5120.0°120.0°
CAYCAAH4H5120.0°120.0°
CAACAYOAGH661.1°60.1°
CAACAYCAMH748.3°64.9°
CAACAYCAMH8168.1°54.3°
OAGCAYCALH16.5°63.6°
OAGCAYCALH2112.8°175.4°
OAGCAYCAAH361.6°179.9°
OAGCAYCAAH4178.4°59.9°
OAGCAYCAAH558.5°60.1°
OAGCAYCAMH769.9°55.2°
OAGCAYCAMH850.0°174.3°
H3CAAH4H5120.0°120.0°
H11CAJCAHH120.1°0.1°
H12CAHCAIH130.3°0.2°

222624

PDB entries from 2024-07-17

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