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BBI

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
CAHCAIdoub1.38Å1.37ÅAromatic
CAHCAGsing1.39Å1.31ÅAromatic
OAFCAGsing1.35Å1.35ÅAromatic
OAFCAEsing1.34Å1.28ÅAromatic
CAICAJsing1.39Å1.37ÅAromatic
CAACABsing1.53Å1.53Å
CAGCALdoub1.40Å1.29ÅAromatic
CACCABsing1.53Å1.54Å
CACCADsing1.53Å1.53Å
CAECADsing1.51Å1.55Å
CAECAMdoub1.36Å1.32ÅAromatic
CAJCAKdoub1.38Å1.37ÅAromatic
CALCAMsing1.48Å1.31ÅAromatic
CALCAKsing1.39Å1.33ÅAromatic
CAMCANsing1.47Å1.31Å
IBDCBCsing2.10Å2.08Å
CBECBCdoub1.38Å1.38ÅAromatic
CBECAPsing1.40Å1.38ÅAromatic
CANCAPsing1.48Å1.36Å
CANOAOdoub1.22Å1.23Å
CBCCATsing1.39Å1.39ÅAromatic
CAPCAQdoub1.40Å1.35ÅAromatic
CATOAUsing1.36Å1.34Å
CATCARdoub1.39Å1.39ÅAromatic
CAQCARsing1.38Å1.35ÅAromatic
OAUCAVsing1.43Å1.42Å
CARIASsing2.09Å2.04Å
CAVCAWsing1.53Å1.52Å
CAWNAXsing1.47Å1.46Å
NAXCAYsing1.47Å1.47Å
NAXCBAsing1.47Å1.49Å
CAYCAZsing1.53Å1.53Å
CBACBBsing1.53Å1.54Å
CAAH1sing1.09Å1.10Å
CAAH2sing1.09Å1.10Å
CAAH3sing1.09Å1.10Å
CABH4sing1.09Å1.10Å
CABH5sing1.09Å1.10Å
CACH6sing1.09Å1.10Å
CACH7sing1.09Å1.10Å
CADH8sing1.09Å1.10Å
CADH9sing1.09Å1.10Å
CAHH10sing1.08Å1.08Å
CAIH11sing1.08Å1.08Å
CAJH12sing1.08Å1.08Å
CAKH13sing1.08Å1.08Å
CBEH14sing1.08Å1.08Å
CAQH15sing1.08Å1.08Å
CAVH16sing1.09Å1.10Å
CAVH17sing1.09Å1.10Å
CAWH18sing1.09Å1.10Å
CAWH19sing1.09Å1.10Å
CBAH21sing1.09Å1.10Å
CBAH22sing1.09Å1.10Å
CBBH23sing1.09Å1.10Å
CBBH24sing1.09Å1.10Å
CBBH25sing1.09Å1.10Å
CAYH26sing1.09Å1.10Å
CAYH27sing1.09Å1.10Å
CAZH28sing1.09Å1.10Å
CAZH29sing1.09Å1.10Å
CAZH30sing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
CAICAHCAG122.0°119.9°
CAHCAICAJ120.3°120.7°
CAICAHH10119.0°120.0°
CAHCAIH11119.8°119.6°
CAHCAGOAF132.8°133.1°
CAHCAGCAL118.1°119.3°
CAGCAHH10119.0°120.0°
CAGOAFCAE107.6°111.4°
OAFCAGCAL109.0°107.6°
OAFCAECAD127.3°125.1°
OAFCAECAM106.9°109.8°
CAICAJCAK114.8°120.2°
CAJCAIH11119.8°119.7°
CAICAJH12122.6°119.9°
CAACABCAC110.3°109.5°
CABCAAH1109.5°109.5°
CABCAAH2109.5°109.5°
CABCAAH3109.5°109.5°
CAACABH4109.3°109.5°
CAACABH5109.3°109.4°
CAGCALCAM105.9°105.5°
CAGCALCAK123.2°120.3°
CABCACCAD109.4°109.5°
CACCABH4109.2°109.5°
CACCABH5109.2°109.5°
CABCACH6109.5°109.5°
CABCACH7109.5°109.4°
CACCADCAE116.3°109.5°
CADCACH6109.5°109.5°
CADCACH7109.5°109.5°
CACCADH8107.7°109.5°
CACCADH9107.7°109.4°
CADCAECAM125.6°125.1°
CAECADH8107.7°109.5°
CAECADH9107.7°109.5°
CAECAMCAL110.5°105.7°
CAECAMCAN128.3°127.2°
CAJCAKCAL121.5°119.6°
CAKCAJH12122.6°119.9°
CAJCAKH13119.3°120.2°
CAMCALCAK130.9°134.2°
CALCAMCAN121.2°127.2°
CALCAKH13119.3°120.2°
CAMCANCAP112.9°120.0°
CAMCANOAO121.9°120.0°
IBDCBCCBE116.0°120.0°
IBDCBCCAT124.9°119.9°
CBCCBECAP119.7°119.9°
CBECBCCAT119.1°120.1°
CBCCBEH14120.1°120.0°
CBECAPCAN123.3°120.1°
CBECAPCAQ119.8°119.8°
CAPCBEH14120.1°120.0°
CAPCANOAO123.6°119.9°
CANCAPCAQ116.9°120.1°
CBCCATOAU117.6°119.9°
CBCCATCAR120.2°120.2°
CAPCAQCAR122.6°119.9°
CAPCAQH15118.7°120.0°
OAUCATCAR122.2°119.9°
CATOAUCAV121.5°117.1°
CATCARCAQ118.5°120.1°
CATCARIAS133.7°120.0°
CAQCARIAS107.8°119.9°
CARCAQH15118.7°120.1°
OAUCAVCAW102.2°109.5°
OAUCAVH16111.2°109.4°
OAUCAVH17111.3°109.5°
CAVCAWNAX113.0°109.5°
CAWCAVH16111.3°109.4°
CAWCAVH17111.2°109.5°
CAVCAWH18108.6°109.5°
CAVCAWH19108.6°109.4°
CAWNAXCAY110.0°111.0°
CAWNAXCBA114.3°111.0°
NAXCAWH18108.6°109.5°
NAXCAWH19108.6°109.5°
CAYNAXCBA113.0°111.0°
NAXCAYCAZ113.9°109.5°
NAXCAYH26108.3°109.5°
NAXCAYH27108.4°109.5°
NAXCBACBB114.5°109.5°
NAXCBAH21108.2°109.5°
NAXCBAH22108.2°109.5°
CAZCAYH26108.3°109.4°
CAZCAYH27108.4°109.4°
CAYCAZH28109.5°109.4°
CAYCAZH29109.5°109.5°
CAYCAZH30109.5°109.5°
CBBCBAH21108.2°109.5°
CBBCBAH22108.2°109.4°
CBACBBH23109.5°109.5°
CBACBBH24109.5°109.5°
CBACBBH25109.5°109.5°
H1CAAH2109.4°109.5°
H1CAAH3109.5°109.4°
H2CAAH3109.4°109.5°
H4CABH5109.5°109.5°
H6CACH7109.5°109.5°
H8CADH9109.5°109.5°
H16CAVH17109.5°109.5°
H18CAWH19109.5°109.5°
H21CBAH22109.4°109.5°
H23CBBH24109.4°109.5°
H23CBBH25109.5°109.5°
H24CBBH25109.4°109.4°
H26CAYH27109.5°109.5°
H28CAZH29109.5°109.5°
H28CAZH30109.5°109.5°
H29CAZH30109.4°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
CAICAHCAGH10180.0°180.0°
CAICAHCAGOAF179.8°180.0°
CAHCAICAJH11180.0°180.0°
CAICAHCAGCAL1.2°0.0°
CAHCAICAJCAK0.3°0.0°
CAHCAICAJH12179.7°179.9°
CAHCAGOAFCAL179.1°180.0°
CAHCAGOAFCAE178.4°180.0°
CAGCAHCAICAJ1.1°0.0°
CAHCAGCALCAM179.9°179.8°
CAHCAGCALCAK0.5°0.0°
CAGCAHCAIH11178.9°180.0°
CAGOAFCAECAD177.9°180.0°
CAGOAFCAECAM1.8°0.3°
OAFCAGCALCAM0.7°0.2°
OAFCAGCALCAK179.8°180.0°
OAFCAGCAHH100.2°0.0°
CAEOAFCAGCAL0.7°0.0°
OAFCAECADCAC74.8°89.7°
OAFCAECADCAM175.4°179.7°
OAFCAECAMCAL2.3°0.4°
OAFCAECAMCAN179.9°179.8°
OAFCAECADH8164.2°150.3°
OAFCAECADH946.2°30.3°
CAICAJCAKH12180.0°179.9°
CAICAJCAKCAL0.3°0.1°
CAJCAICAHH10178.9°180.0°
CAICAJCAKH13179.7°180.0°
CAACABCACH4120.1°120.0°
CAACABCACH5120.1°120.0°
CAACABCACCAD136.3°180.0°
CABCAAH1H2120.0°120.0°
CABCAAH1H3120.0°120.0°
CABCAAH2H3120.0°120.0°
CAACABH4H5119.7°119.9°
CAACABCACH616.3°60.0°
CAACABCACH7103.7°60.0°
CAGCALCAMCAE1.8°0.4°
CAGCALCAKCAJ0.2°0.1°
CAGCALCAMCAK179.5°179.7°
CAGCALCAMCAN179.8°179.8°
CALCAGCAHH10178.8°180.0°
CAGCALCAKH13179.8°180.0°
CABCACCADH6120.0°120.0°
CABCACCADH7120.0°119.9°
CABCACCADCAE177.7°180.0°
CACCABCAAH1180.0°60.1°
CACCABCAAH260.0°60.0°
CACCABCAAH360.0°180.0°
CACCABH4H5119.6°120.0°
CABCACH6H7120.0°119.9°
CABCACCADH861.3°60.0°
CABCACCADH956.7°60.0°
CACCADCAEH8121.0°120.0°
CACCADCAEH9121.0°120.0°
CACCADCAECAM109.8°90.0°
CADCACCABH4103.6°60.0°
CADCACCABH516.1°60.0°
CADCACH6H7120.0°120.0°
CACCADH8H9116.9°119.9°
CADCAECAMCAL178.5°179.9°
CADCAECAMCAN3.7°0.1°
CAECADCACH657.7°60.0°
CAECADCACH762.3°60.0°
CAECADH8H9116.9°120.0°
CAECAMCALCAN178.0°179.8°
CAECAMCALCAK178.7°179.9°
CAECAMCANCAP72.0°85.6°
CAECAMCANOAO121.7°94.4°
CAMCAECADH811.2°30.0°
CAMCAECADH9129.2°150.0°
CAJCAKCALCAM179.2°179.7°
CAJCAKCALH13180.0°179.9°
CAKCAJCAIH11179.7°179.9°
CALCAMCANCAP105.5°94.2°
CALCAMCANOAO60.7°85.8°
CAMCALCAKH130.8°0.3°
CAKCALCAMCAN0.7°0.1°
CALCAKCAJH12179.7°179.9°
CAMCANCAPCBE34.5°5.4°
CAMCANCAPOAO166.0°180.0°
CAMCANCAPCAQ142.8°174.8°
IBDCBCCBECAT179.8°180.0°
IBDCBCCBECAP179.5°180.0°
IBDCBCCATOAU0.9°0.0°
IBDCBCCATCAR179.8°179.7°
IBDCBCCBEH140.5°0.0°
CBCCBECAPH14180.0°180.0°
CBCCBECAPCAN178.6°180.0°
CBCCBECAPCAQ1.3°0.3°
CBECBCCATOAU178.9°180.0°
CBECBCCATCAR0.4°0.3°
CBECAPCANCAQ177.4°179.7°
CBECAPCANOAO159.5°174.6°
CAPCBECBCCAT0.6°0.0°
CBECAPCAQCAR1.7°0.3°
CBECAPCAQH15178.3°179.7°
CANCAPCAQCAR179.2°180.0°
CANCAPCBEH141.4°0.0°
CANCAPCAQH150.8°0.0°
OAOCANCAPCAQ23.1°5.1°
CBCCATOAUCAR179.3°179.7°
CBCCATCARCAQ0.8°0.2°
CBCCATOAUCAV159.2°90.0°
CBCCATCARIAS179.2°179.8°
CATCBCCBEH14179.4°180.0°
CAPCAQCARCAT1.4°0.1°
CAPCAQCARH15180.0°180.0°
CAPCAQCARIAS179.8°180.0°
CAQCAPCBEH14178.7°179.7°
OAUCATCARCAQ178.5°179.9°
OAUCATCARIAS0.1°0.1°
CATOAUCAVCAW153.2°180.0°
CATOAUCAVH1634.4°60.0°
CATOAUCAVH1788.0°59.9°
CATCARCAQIAS178.8°180.0°
CARCATOAUCAV21.6°89.7°
CATCARCAQH15178.6°180.0°
OAUCAVCAWH16118.8°120.0°
OAUCAVCAWH17118.8°120.1°
OAUCAVCAWNAX122.5°64.9°
OAUCAVH16H17123.4°120.0°
OAUCAVCAWH182.0°175.0°
OAUCAVCAWH19116.9°55.0°
IASCARCAQH150.2°0.0°
CAVCAWNAXH18120.5°120.0°
CAVCAWNAXH19120.5°120.0°
CAVCAWNAXCAY179.2°170.0°
CAVCAWNAXCBA52.6°66.1°
CAWCAVH16H17123.4°120.0°
CAVCAWH18H19118.4°119.9°
CAWNAXCAYCBA129.0°124.0°
CAWNAXCAYCAZ87.0°76.3°
CAWNAXCBACBB35.6°166.3°
NAXCAWCAVH16118.7°55.0°
NAXCAWCAVH173.7°175.0°
NAXCAWH18H19118.4°120.0°
CAWNAXCBAH2185.1°46.3°
CAWNAXCBAH22156.4°73.7°
CAWNAXCAYH26152.4°163.8°
CAWNAXCAYH2733.7°43.7°
NAXCAYCAZH26120.7°120.0°
NAXCAYCAZH27120.7°120.0°
CAYNAXCBACBB91.1°69.7°
CAYNAXCAWH1858.7°70.0°
CAYNAXCAWH1960.3°50.0°
CAYNAXCBAH21148.2°170.3°
CAYNAXCBAH2229.7°50.3°
NAXCAYH26H27118.0°120.1°
NAXCAYCAZH28180.0°55.6°
NAXCAYCAZH2960.0°64.3°
NAXCAYCAZH3060.0°175.6°
CBANAXCAYCAZ42.0°159.8°
NAXCBACBBH21120.7°120.0°
NAXCBACBBH22120.8°120.0°
CBANAXCAWH18173.0°53.9°
CBANAXCAWH1967.9°174.0°
NAXCBAH21H22117.7°120.0°
NAXCBACBBH23180.0°59.7°
NAXCBACBBH2460.0°60.3°
NAXCBACBBH2560.0°179.7°
CBANAXCAYH2678.6°39.8°
CBANAXCAYH27162.7°80.2°
CAZCAYH26H27118.0°119.9°
CAYCAZH28H29120.0°120.0°
CAYCAZH28H30120.0°120.0°
CAYCAZH29H30120.0°120.0°
CBBCBAH21H22117.7°119.9°
CBACBBH23H24120.0°120.0°
CBACBBH23H25120.0°120.1°
CBACBBH24H25120.0°120.0°
H1CAAH2H3120.0°120.0°
H1CAACABH459.9°60.0°
H1CAACABH559.9°179.9°
H2CAACABH460.1°180.0°
H2CAACABH5179.9°60.0°
H3CAACABH4179.9°60.0°
H3CAACABH560.1°60.0°
H4CABCACH6136.4°180.0°
H4CABCACH716.4°60.0°
H5CABCACH6103.8°60.0°
H5CABCACH7136.1°180.0°
H6CACCADH8178.7°NaN°
H6CACCADH963.3°60.0°
H7CACCADH858.7°60.0°
H7CACCADH9176.7°179.9°
H10CAHCAIH111.1°0.0°
H11CAICAJH120.3°0.1°
H12CAJCAKH130.3°0.1°
H16CAVCAWH18120.8°65.0°
H16CAVCAWH191.8°175.0°
H17CAVCAWH18116.8°55.0°
H17CAVCAWH19124.2°65.0°
H21CBACBBH2359.3°179.7°
H21CBACBBH24179.3°59.7°
H21CBACBBH2560.8°60.2°
H22CBACBBH2359.2°60.3°
H22CBACBBH2460.8°179.7°
H22CBACBBH25179.3°59.7°
H23CBBH24H25120.0°120.0°
H26CAYCAZH2859.3°175.7°
H26CAYCAZH29179.4°55.7°
H26CAYCAZH3060.7°64.3°
H27CAYCAZH2859.3°64.4°
H27CAYCAZH2960.7°175.6°
H27CAYCAZH30179.4°55.6°
H28CAZH29H30120.0°120.0°

221716

PDB entries from 2024-06-26

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