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B71

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
CAACALsing1.52Å1.53Å
CAAHAA1sing1.10Å1.10Å
CAAHAA2sing1.10Å1.10Å
CAAHAA3sing1.09Å1.10Å
CALCAMsing1.53Å1.53Å
CALHAL1sing1.10Å1.10Å
CALHAL2sing1.10Å1.10Å
CAMCANsing1.53Å1.53Å
CAMHAM1sing1.10Å1.10Å
CAMHAM2sing1.10Å1.10Å
CANCAOsing1.53Å1.53Å
CANHAN1sing1.10Å1.10Å
CANHAN2sing1.10Å1.10Å
CAOCAPsing1.53Å1.53Å
CAOHAO1sing1.10Å1.10Å
CAOHAO2sing1.10Å1.10Å
CAPCAQsing1.53Å1.53Å
CAPHAP1sing1.10Å1.10Å
CAPHAP2sing1.10Å1.10Å
CAQCARsing1.53Å1.53Å
CAQHAQ1sing1.10Å1.10Å
CAQHAQ2sing1.10Å1.10Å
CARCASsing1.53Å1.53Å
CARHAR1sing1.10Å1.10Å
CARHAR2sing1.10Å1.10Å
CASCATsing1.52Å1.53Å
CASHAS1sing1.10Å1.10Å
CASHAS2sing1.10Å1.10Å
CATOAVsing1.42Å1.44Å
CATHAT1sing1.09Å1.10Å
CATHAT2sing1.09Å1.10Å
OAVCAWsing1.37Å1.36Å
CAWCAIdoub1.38Å1.39ÅAromatic
CAWCAKsing1.38Å1.39ÅAromatic
CAKNAYdoub1.34Å1.40ÅAromatic
CAKHAKsing1.08Å1.08Å
CAICAHsing1.39Å1.39ÅAromatic
CAIHAIsing1.09Å1.08Å
CAHCAJdoub1.39Å1.39ÅAromatic
CAHHAHsing1.09Å1.08Å
CAJNAYsing1.34Å1.40ÅAromatic
CAJHAJsing1.08Å1.08Å
NAYCAUsing1.46Å1.48Å
CAUCAXsing1.54Å1.53Å
CAUHAU1sing1.10Å1.10Å
CAUHAU2sing1.10Å1.10Å
CAXPBAsing1.84Å1.84Å
CAXPAZsing1.85Å1.84Å
CAXHAXsing1.10Å1.10Å
PBAOAFdoub1.50Å1.61Å
PBAOAGsing1.62Å1.61Å
PBAOACsing1.62Å1.48Å
OAGHOAGsing0.98Å0.95Å
OACHOACsing0.98Å0.95Å
PAZOAEdoub1.50Å1.61Å
PAZOABsing1.62Å1.48Å
PAZOADsing1.62Å1.61Å
OADHOADsing0.98Å0.95Å
OABHOABsing0.98Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
CALCAAHAA1109.5°111.0°
CALCAAHAA2109.5°111.0°
CALCAAHAA3109.5°110.3°
CAACALCAM110.5°111.5°
CAACALHAL1109.2°109.1°
CAACALHAL2108.9°109.1°
HAA1CAAHAA2109.4°108.3°
HAA1CAAHAA3109.4°108.0°
HAA2CAAHAA3109.5°108.1°
CAMCALHAL1109.2°109.9°
CAMCALHAL2108.9°109.9°
CALCAMCAN110.6°111.3°
CALCAMHAM1109.1°109.6°
CALCAMHAM2108.8°109.6°
HAL1CALHAL2110.2°107.2°
CANCAMHAM1109.1°109.5°
CANCAMHAM2108.9°109.6°
CAMCANCAO112.3°111.2°
CAMCANHAN1108.6°109.1°
CAMCANHAN2107.9°109.5°
HAM1CAMHAM2110.4°107.1°
CAOCANHAN1108.5°110.1°
CAOCANHAN2107.9°109.6°
CANCAOCAP111.9°113.4°
CANCAOHAO1108.7°109.7°
CANCAOHAO2108.1°109.1°
HAN1CANHAN2111.7°107.3°
CAPCAOHAO1108.7°109.5°
CAPCAOHAO2108.1°108.1°
CAOCAPCAQ109.9°113.4°
CAOCAPHAP1109.3°109.6°
CAOCAPHAP2109.2°108.0°
HAO1CAOHAO2111.4°106.7°
CAQCAPHAP1109.3°109.8°
CAQCAPHAP2109.2°109.0°
CAPCAQCAR112.2°111.1°
CAPCAQHAQ1108.6°109.6°
CAPCAQHAQ2108.0°110.1°
HAP1CAPHAP2109.8°106.7°
CARCAQHAQ1108.6°109.5°
CARCAQHAQ2107.9°109.0°
CAQCARCAS110.6°111.2°
CAQCARHAR1109.1°109.5°
CAQCARHAR2108.9°109.4°
HAQ1CAQHAQ2111.6°107.3°
CASCARHAR1109.1°109.5°
CASCARHAR2108.8°109.9°
CARCASCAT112.2°112.2°
CARCASHAS1108.6°109.7°
CARCASHAS2107.9°108.9°
HAR1CARHAR2110.4°107.2°
CATCASHAS1108.6°109.1°
CATCASHAS2108.0°109.3°
CASCATOAV106.4°109.9°
CASCATHAT1110.5°110.0°
CASCATHAT2111.2°111.0°
HAS1CASHAS2111.6°107.7°
OAVCATHAT1110.5°108.3°
OAVCATHAT2111.2°108.8°
CATOAVCAW113.7°116.9°
HAT1CATHAT2107.1°108.7°
OAVCAWCAI118.7°120.2°
OAVCAWCAK121.1°120.1°
CAICAWCAK120.1°119.7°
CAWCAICAH120.6°119.4°
CAWCAIHAI119.7°120.8°
CAWCAKNAY119.5°119.6°
CAWCAKHAK120.3°123.5°
NAYCAKHAK120.2°116.9°
CAKNAYCAJ120.2°122.3°
CAKNAYCAU120.1°118.9°
CAHCAIHAI119.7°119.8°
CAICAHCAJ119.8°118.8°
CAICAHHAH120.1°120.6°
CAJCAHHAH120.1°120.6°
CAHCAJNAY119.8°120.1°
CAHCAJHAJ120.1°122.8°
NAYCAJHAJ120.1°117.1°
CAJNAYCAU119.6°118.8°
NAYCAUCAX111.2°111.5°
NAYCAUHAU1108.9°106.3°
NAYCAUHAU2108.5°108.7°
CAXCAUHAU1108.9°112.0°
CAXCAUHAU2108.5°110.8°
CAUCAXPBA109.6°111.3°
CAUCAXPAZ111.1°109.5°
CAUCAXHAX109.3°109.6°
HAU1CAUHAU2110.8°107.3°
PBACAXPAZ112.4°117.5°
PBACAXHAX107.9°104.9°
CAXPBAOAF106.1°114.4°
CAXPBAOAG108.1°102.8°
CAXPBAOAC111.0°104.1°
PAZCAXHAX106.3°103.4°
CAXPAZOAE108.2°113.9°
CAXPAZOAB111.4°103.9°
CAXPAZOAD106.4°103.2°
OAFPBAOAG107.1°115.2°
OAFPBAOAC113.4°115.8°
OAGPBAOAC110.9°102.9°
PBAOAGHOAG109.5°118.9°
PBAOACHOAC109.5°119.0°
OAEPAZOAB112.1°115.1°
OAEPAZOAD106.9°115.3°
OABPAZOAD111.6°104.0°
PAZOABHOAB109.5°119.0°
PAZOADHOAD109.5°119.0°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
CALCAAHAA1HAA2120.0°122.1°
CALCAAHAA1HAA3120.0°121.1°
CALCAAHAA2HAA3120.0°121.1°
CAACALCAMHAL1120.0°121.1°
CAACALCAMHAL2119.6°121.1°
CAACALHAL1HAL2119.6°118.1°
CAACALCAMCAN171.2°178.7°
CAACALCAMHAM168.8°60.0°
CAACALCAMHAM251.7°57.3°
HAA1CAAHAA2HAA3120.0°116.8°
HAA1CAACALCAM1.0°60.3°
HAA1CAACALHAL1121.0°178.1°
HAA1CAACALHAL2118.6°61.3°
HAA2CAACALCAM119.0°60.2°
HAA2CAACALHAL11.0°61.4°
HAA2CAACALHAL2121.4°178.2°
HAA3CAACALCAM121.0°180.0°
HAA3CAACALHAL1119.0°58.4°
HAA3CAACALHAL21.4°58.5°
CAMCALHAL1HAL2119.6°119.4°
CALCAMCANHAM1120.0°121.4°
CALCAMCANHAM2119.5°121.4°
CALCAMHAM1HAM2119.5°118.8°
CALCAMCANCAO67.8°178.4°
CALCAMCANHAN1172.2°60.0°
CALCAMCANHAN251.0°57.2°
HAL1CALCAMCAN51.2°57.5°
HAL1CALCAMHAM1171.2°178.9°
HAL1CALCAMHAM268.3°63.8°
HAL2CALCAMCAN69.1°60.2°
HAL2CALCAMHAM150.8°61.1°
HAL2CALCAMHAM2171.3°178.4°
CANCAMHAM1HAM2119.6°118.8°
CAMCANCAOHAN1120.0°121.0°
CAMCANCAOHAN2118.8°121.2°
CAMCANHAN1HAN2118.9°118.6°
CAMCANCAOCAP73.8°177.1°
CAMCANCAOHAO1166.2°60.1°
CAMCANCAOHAO245.2°56.5°
HAM1CAMCANCAO52.2°60.2°
HAM1CAMCANHAN167.8°61.4°
HAM1CAMCANHAN2171.0°178.6°
HAM2CAMCANCAO172.7°57.1°
HAM2CAMCANHAN152.7°178.6°
HAM2CAMCANHAN268.5°64.2°
CAOCANHAN1HAN2118.8°119.2°
CANCAOCAPHAO1120.0°123.0°
CANCAOCAPHAO2119.0°121.1°
CANCAOHAO1HAO2119.0°118.1°
CANCAOCAPCAQ172.5°176.9°
CANCAOCAPHAP167.4°59.9°
CANCAOCAPHAP252.7°56.0°
HAN1CANCAOCAP46.3°62.0°
HAN1CANCAOHAO173.8°60.9°
HAN1CANCAOHAO2165.2°177.5°
HAN2CANCAOCAP167.4°55.8°
HAN2CANCAOHAO147.4°178.7°
HAN2CANCAOHAO273.6°64.7°
CAPCAOHAO1HAO2119.0°116.8°
CAOCAPCAQHAP1120.0°123.0°
CAOCAPCAQHAP2119.8°120.4°
CAOCAPHAP1HAP2119.8°116.8°
CAOCAPCAQCAR172.5°178.8°
CAOCAPCAQHAQ152.5°60.0°
CAOCAPCAQHAQ268.7°57.9°
HAO1CAOCAPCAQ52.6°60.1°
HAO1CAOCAPHAP1172.6°63.0°
HAO1CAOCAPHAP267.3°179.0°
HAO2CAOCAPCAQ68.5°55.9°
HAO2CAOCAPHAP151.5°179.0°
HAO2CAOCAPHAP2171.7°65.1°
CAQCAPHAP1HAP2119.8°118.0°
CAPCAQCARHAQ1120.0°121.3°
CAPCAQCARHAQ2118.8°121.5°
CAPCAQHAQ1HAQ2118.9°119.5°
CAPCAQCARCAS57.8°178.8°
CAPCAQCARHAR1177.8°60.0°
CAPCAQCARHAR261.8°57.3°
HAP1CAPCAQCAR67.5°55.8°
HAP1CAPCAQHAQ1172.5°177.0°
HAP1CAPCAQHAQ251.3°65.1°
HAP2CAPCAQCAR52.7°60.8°
HAP2CAPCAQHAQ167.3°60.4°
HAP2CAPCAQHAQ2171.5°178.3°
CARCAQHAQ1HAQ2118.9°118.2°
CAQCARCASHAR1120.0°121.2°
CAQCARCASHAR2119.5°121.3°
CAQCARHAR1HAR2119.6°118.6°
CAQCARCASCAT171.9°178.6°
CAQCARCASHAS168.1°60.0°
CAQCARCASHAS253.1°57.6°
HAQ1CAQCARCAS62.2°57.5°
HAQ1CAQCARHAR157.7°178.7°
HAQ1CAQCARHAR2178.2°64.1°
HAQ2CAQCARCAS176.6°59.7°
HAQ2CAQCARHAR163.4°61.5°
HAQ2CAQCARHAR257.1°178.8°
CASCARHAR1HAR2119.5°119.2°
CARCASCATHAS1120.0°121.7°
CARCASCATHAS2118.8°120.8°
CARCASHAS1HAS2118.9°118.3°
CARCASCATOAV173.5°179.2°
CARCASCATHAT166.5°60.0°
CARCASCATHAT252.3°60.4°
HAR1CARCASCAT51.9°60.2°
HAR1CARCASHAS1171.9°61.2°
HAR1CARCASHAS266.9°178.8°
HAR2CARCASCAT68.5°57.4°
HAR2CARCASHAS151.5°178.7°
HAR2CARCASHAS2172.6°63.7°
CATCASHAS1HAS2118.9°118.5°
CASCATOAVHAT1120.0°120.2°
CASCATOAVHAT2121.2°121.7°
CASCATHAT1HAT2121.2°121.7°
CASCATOAVCAW149.8°179.8°
HAS1CASCATOAV53.5°57.4°
HAS1CASCATHAT1173.5°61.7°
HAS1CASCATHAT267.7°177.9°
HAS2CASCATOAV67.7°60.0°
HAS2CASCATHAT152.3°179.2°
HAS2CASCATHAT2171.1°60.4°
OAVCATHAT1HAT2121.2°118.1°
CATOAVCAWCAI154.7°180.0°
CATOAVCAWCAK29.3°0.0°
HAT1CATOAVCAW29.8°60.0°
HAT2CATOAVCAW89.0°58.1°
OAVCAWCAICAK176.1°180.0°
OAVCAWCAKNAY175.5°180.0°
OAVCAWCAKHAK4.5°0.0°
OAVCAWCAICAH175.6°180.0°
OAVCAWCAIHAI4.4°0.0°
CAICAWCAKNAY0.5°0.0°
CAICAWCAKHAK179.5°179.9°
CAWCAICAHHAI180.0°179.9°
CAWCAICAHCAJ0.2°0.0°
CAWCAICAHHAH179.8°180.0°
CAWCAKNAYHAK180.0°179.9°
CAKCAWCAICAH0.5°0.0°
CAKCAWCAIHAI179.5°180.0°
CAWCAKNAYCAJ0.2°0.0°
CAWCAKNAYCAU178.3°180.0°
CAKNAYCAJCAH0.1°0.0°
CAKNAYCAJCAU178.6°179.9°
CAKNAYCAJHAJ179.9°180.0°
CAKNAYCAUCAX74.0°90.0°
CAKNAYCAUHAU146.0°147.7°
CAKNAYCAUHAU2166.8°32.5°
HAKCAKNAYCAJ179.8°180.0°
HAKCAKNAYCAU1.7°0.1°
CAICAHCAJHAH180.0°180.0°
CAICAHCAJNAY0.1°0.0°
CAICAHCAJHAJ179.9°180.0°
HAICAICAHCAJ179.8°179.9°
HAICAICAHHAH0.2°0.1°
CAHCAJNAYHAJ180.0°180.0°
CAHCAJNAYCAU178.6°180.0°
HAHCAHCAJNAY179.9°180.0°
HAHCAHCAJHAJ0.1°0.0°
CAJNAYCAUCAX107.4°90.0°
CAJNAYCAUHAU1132.5°32.4°
CAJNAYCAUHAU211.8°147.6°
HAJCAJNAYCAU1.3°0.0°
NAYCAUCAXHAU1120.0°119.0°
NAYCAUCAXHAU2119.3°121.3°
NAYCAUHAU1HAU2119.3°116.2°
NAYCAUCAXPBA170.0°55.5°
NAYCAUCAXPAZ65.1°172.8°
NAYCAUCAXHAX51.9°60.0°
CAXCAUHAU1HAU2119.3°121.7°
CAUCAXPBAPAZ124.1°127.4°
CAUCAXPBAHAX119.0°118.4°
CAUCAXPAZHAX118.9°116.8°
CAUCAXPBAOAF55.0°60.0°
CAUCAXPBAOAG169.6°174.4°
CAUCAXPBAOAC68.6°67.3°
CAUCAXPAZOAE60.0°60.0°
CAUCAXPAZOAB63.6°174.0°
CAUCAXPAZOAD174.6°65.7°
HAU1CAUCAXPBA50.0°174.6°
HAU1CAUCAXPAZ174.9°53.8°
HAU1CAUCAXHAX68.1°59.0°
HAU2CAUCAXPBA70.7°65.7°
HAU2CAUCAXPAZ54.1°65.9°
HAU2CAUCAXHAX171.2°178.7°
PBACAXPAZHAX117.9°114.9°
CAXPBAOAFOAG115.3°118.9°
CAXPBAOAFOAC122.1°121.0°
CAXPBAOAGOAC121.9°108.0°
CAXPBAOAGHOAG115.6°177.3°
CAXPBAOACHOAC47.5°178.1°
PBACAXPAZOAE63.2°68.3°
PBACAXPAZOAB173.1°57.7°
PBACAXPAZOAD51.3°166.0°
PAZCAXPBAOAF69.1°67.4°
PAZCAXPBAOAG45.5°58.2°
PAZCAXPBAOAC167.4°165.3°
CAXPAZOAEOAB123.2°119.9°
CAXPAZOAEOAD114.2°119.1°
CAXPAZOABOAD118.7°107.7°
CAXPAZOADHOAD114.4°177.0°
CAXPAZOABHOAB123.7°177.5°
HAXCAXPBAOAF174.0°178.4°
HAXCAXPBAOAG71.4°55.9°
HAXCAXPBAOAC50.4°51.1°
HAXCAXPAZOAE178.9°176.8°
HAXCAXPAZOAB55.3°57.2°
HAXCAXPAZOAD66.6°51.1°
OAFPBAOAGOAC124.2°126.9°
OAFPBAOAGHOAG1.7°52.2°
OAFPBAOACHOAC166.7°51.7°
OAGPBAOACHOAC72.7°74.9°
OACPBAOAGHOAG122.5°74.8°
OAEPAZOABOAD119.8°127.0°
OAEPAZOADHOAD1.0°52.2°
OAEPAZOABHOAB2.3°52.3°
OABPAZOADHOAD123.9°74.8°
OADPAZOABHOAB117.5°74.8°

222415

PDB entries from 2024-07-10

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