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2E3

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
CAACASsing1.51Å1.54Å
CAAHAAsing1.09Å1.10Å
CAAHAAAsing1.09Å1.10Å
CAAHAABsing1.09Å1.10Å
CASCAVdoub1.39Å1.40ÅAromatic
CASCANsing1.38Å1.40ÅAromatic
CANCAXdoub1.39Å1.40ÅAromatic
CANHANsing1.08Å1.08Å
CAXCAYsing1.38Å1.41ÅAromatic
CAXCAZsing1.51Å1.56Å
CACCAZsing1.53Å1.54Å
CAZCABsing1.53Å1.53Å
CAZCAPsing1.53Å1.52Å
CABHABsing1.09Å1.10Å
CABHABAsing1.09Å1.10Å
CABHABBsing1.09Å1.10Å
CACHACsing1.09Å1.10Å
CACHACAsing1.09Å1.10Å
CACHACBsing1.09Å1.10Å
CAPCAQsing1.53Å1.52Å
CAPHAPsing1.09Å1.10Å
CAPHAPAsing1.09Å1.10Å
CBACAQsing1.53Å1.54Å
CAQHAQsing1.09Å1.10Å
CAQHAQAsing1.09Å1.10Å
CAYCBAsing1.51Å1.55Å
CADCBAsing1.53Å1.50Å
CBACAEsing1.53Å1.54Å
CADHADsing1.09Å1.10Å
CADHADAsing1.09Å1.10Å
CADHADBsing1.09Å1.10Å
CAEHAEsing1.09Å1.10Å
CAEHAEAsing1.09Å1.10Å
CAEHAEBsing1.09Å1.10Å
CAOCAYdoub1.39Å1.41ÅAromatic
CAVCAOsing1.39Å1.40ÅAromatic
CAOHAOsing1.08Å1.08Å
CAWCAVsing1.48Å1.41ÅAromatic
CAUCAWdoub1.40Å1.40ÅAromatic
CAWCAMsing1.39Å1.40ÅAromatic
CATCAMdoub1.40Å1.40ÅAromatic
CAMHAMsing1.08Å1.08Å
CALCAUsing1.39Å1.40ÅAromatic
OAHCAUsing1.36Å1.37Å
OAHHOAHsing0.97Å0.95Å
CALCAKdoub1.38Å1.41ÅAromatic
CALHALsing1.08Å1.08Å
CAKCATsing1.40Å1.40ÅAromatic
CAKHAKsing1.08Å1.08Å
CATCAJsing1.47Å1.41Å
CAICAJdoub1.35Å1.40Å
CAJHAJsing1.08Å1.08Å
CAICARsing1.42Å1.40Å
CAIHAIsing1.08Å1.08Å
OAFCARdoub1.22Å1.25Å
CAROAGsing1.35Å1.25Å
OAGHOAGsing0.97Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
CASCAAHAA109.5°109.5°
CASCAAHAAA109.5°109.5°
CASCAAHAAB109.5°109.4°
CAACASCAV122.4°120.2°
CAACASCAN117.7°120.2°
HAACAAHAAA109.5°109.5°
HAACAAHAAB109.5°109.4°
HAAACAAHAAB109.5°109.5°
CAVCASCAN119.8°119.6°
CASCAVCAO118.3°119.5°
CASCAVCAW122.8°120.2°
CASCANCAX122.2°120.8°
CASCANHAN118.9°119.7°
CAXCANHAN118.9°119.6°
CANCAXCAY118.5°119.8°
CANCAXCAZ118.1°117.7°
CAYCAXCAZ123.4°122.5°
CAXCAYCBA121.9°122.5°
CAXCAYCAO119.0°119.8°
CAXCAZCAC109.6°109.3°
CAXCAZCAB110.5°109.3°
CAXCAZCAP113.2°110.6°
CACCAZCAB108.3°109.2°
CACCAZCAP110.9°109.2°
CAZCACHAC109.5°109.5°
CAZCACHACA109.5°109.5°
CAZCACHACB109.5°109.4°
CABCAZCAP104.1°109.2°
CAZCABHAB109.5°109.5°
CAZCABHABA109.5°109.5°
CAZCABHABB109.5°109.5°
CAZCAPCAQ117.3°108.4°
CAZCAPHAP106.9°109.7°
CAZCAPHAPA105.1°109.6°
HABCABHABA109.5°109.5°
HABCABHABB109.5°109.4°
HABACABHABB109.5°109.5°
HACCACHACA109.4°109.5°
HACCACHACB109.5°109.5°
HACACACHACB109.5°109.4°
CAQCAPHAP106.9°109.7°
CAQCAPHAPA105.1°109.7°
CAPCAQCBA116.4°108.4°
CAPCAQHAQ107.2°109.6°
CAPCAQHAQA105.6°109.7°
HAPCAPHAPA115.8°109.7°
CBACAQHAQ107.2°109.7°
CBACAQHAQA105.6°109.7°
CAQCBACAY114.1°110.6°
CAQCBACAD104.8°109.2°
CAQCBACAE111.7°109.2°
HAQCAQHAQA115.1°109.7°
CAYCBACAD108.4°109.3°
CAYCBACAE108.5°109.2°
CBACAYCAO119.1°117.6°
CADCBACAE109.2°109.3°
CBACADHAD109.5°109.5°
CBACADHADA109.5°109.5°
CBACADHADB109.4°109.5°
CBACAEHAE109.5°109.5°
CBACAEHAEA109.5°109.4°
CBACAEHAEB109.4°109.5°
HADCADHADA109.5°109.5°
HADCADHADB109.5°109.5°
HADACADHADB109.5°109.4°
HAECAEHAEA109.4°109.4°
HAECAEHAEB109.5°109.5°
HAEACAEHAEB109.5°109.5°
CAYCAOCAV122.1°120.4°
CAYCAOHAO119.0°119.8°
CAVCAOHAO119.0°119.8°
CAOCAVCAW118.8°120.2°
CAVCAWCAU121.0°120.1°
CAVCAWCAM119.9°120.0°
CAUCAWCAM119.1°119.9°
CAWCAUCAL119.9°120.1°
CAWCAUOAH119.3°119.9°
CAWCAMCAT121.9°119.7°
CAWCAMHAM119.0°120.1°
CATCAMHAM119.1°120.2°
CAMCATCAK118.5°119.9°
CAMCATCAJ117.8°120.1°
CALCAUOAH120.8°119.9°
CAUCALCAK120.2°120.2°
CAUCALHAL119.9°119.9°
CAUOAHHOAH109.5°114.0°
CAKCALHAL119.9°119.9°
CALCAKCAT120.3°120.1°
CALCAKHAK119.8°119.9°
CATCAKHAK119.9°120.0°
CAKCATCAJ123.6°120.0°
CATCAJCAI121.9°120.0°
CATCAJHAJ119.0°120.0°
CAICAJHAJ119.0°120.0°
CAJCAICAR125.2°120.0°
CAJCAIHAI117.4°120.0°
CARCAIHAI117.4°120.0°
CAICAROAF116.9°120.0°
CAICAROAG120.0°119.9°
OAFCAROAG123.0°120.1°
CAROAGHOAG109.5°114.0°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
CASCAAHAAHAAA120.0°120.0°
CASCAAHAAHAAB120.0°119.9°
CASCAAHAAAHAAB120.0°120.0°
CAACASCAVCAN179.4°179.6°
CAACASCANCAX179.1°179.9°
CAACASCANHAN0.9°0.0°
CAACASCAVCAO179.5°179.8°
CAACASCAVCAW0.5°0.2°
HAACAAHAAAHAAB120.0°120.0°
HAACAACASCAV121.6°89.9°
HAACAACASCAN57.8°89.7°
HAAACAACASCAV1.6°150.1°
HAAACAACASCAN177.8°30.3°
HAABCAACASCAV118.4°30.0°
HAABCAACASCAN62.2°150.4°
CAVCASCANCAX0.3°0.4°
CAVCASCANHAN179.6°179.7°
CASCAVCAOCAY0.8°0.6°
CASCAVCAOCAW180.0°179.7°
CASCAVCAOHAO179.2°179.7°
CASCAVCAWCAU75.9°64.7°
CASCAVCAWCAM106.1°115.1°
CASCANCAXHAN180.0°179.9°
CASCANCAXCAY0.2°0.4°
CASCANCAXCAZ179.4°179.3°
CANCASCAVCAO0.2°0.5°
CANCASCAVCAW179.8°179.8°
CANCAXCAYCAZ179.6°179.7°
CANCAXCAZCAC66.0°42.2°
CANCAXCAZCAB53.3°77.3°
CANCAXCAZCAP169.6°162.5°
CANCAXCAYCBA179.6°179.4°
CANCAXCAYCAO0.4°0.4°
HANCANCAXCAY179.7°179.7°
HANCANCAXCAZ0.6°0.6°
CAYCAXCAZCAC114.4°138.1°
CAYCAXCAZCAB126.4°102.4°
CAYCAXCAZCAP10.0°17.9°
CAXCAYCBACAQ10.1°17.9°
CAXCAYCBACAO179.2°179.8°
CAXCAYCBACAD126.4°102.3°
CAXCAYCBACAE115.1°138.2°
CAXCAYCAOCAV0.9°0.5°
CAXCAYCAOHAO179.1°179.7°
CAXCAZCACCAB120.6°119.5°
CAXCAZCACCAP125.7°121.1°
CAXCAZCABCAP121.9°121.1°
CAXCAZCABHAB127.2°59.9°
CAXCAZCABHABA7.1°180.0°
CAXCAZCABHABB112.8°60.0°
CAXCAZCACHAC19.9°60.0°
CAXCAZCACHACA100.1°180.0°
CAXCAZCACHACB139.9°60.0°
CAXCAZCAPCAQ32.6°51.1°
CAXCAZCAPHAP87.4°170.9°
CAXCAZCAPHAPA148.9°68.6°
CAZCAXCAYCBA0.8°0.9°
CAZCAXCAYCAO180.0°179.3°
CACCAZCABCAP118.1°119.4°
CACCAZCABHAB112.8°59.5°
CACCAZCABHABA127.2°60.5°
CACCAZCABHABB7.2°179.5°
CAZCACHACHACA120.0°120.1°
CAZCACHACHACB120.0°120.0°
CAZCACHACAHACB120.0°120.0°
CACCAZCAPCAQ91.1°171.4°
CACCAZCAPHAP148.9°68.8°
CACCAZCAPHAPA25.2°51.7°
CAZCABHABHABA120.0°120.1°
CAZCABHABHABB120.0°120.0°
CAZCABHABAHABB120.0°120.0°
CABCAZCACHAC100.7°179.5°
CABCAZCACHACA139.3°60.5°
CABCAZCACHACB19.3°59.5°
CABCAZCAPCAQ152.6°69.2°
CABCAZCAPHAP32.6°50.6°
CABCAZCAPHAPA91.0°171.1°
CAPCAZCABHAB5.3°178.9°
CAPCAZCABHABA114.7°58.9°
CAPCAZCABHABB125.3°61.2°
CAPCAZCACHAC145.6°61.1°
CAPCAZCACHACA25.7°58.9°
CAPCAZCACHACB94.4°178.9°
CAZCAPCAQHAP120.0°119.7°
CAZCAPCAQHAPA116.3°119.7°
CAZCAPHAPHAPA116.8°120.5°
CAZCAPCAQCBA45.3°69.8°
CAZCAPCAQHAQ165.3°49.8°
CAZCAPCAQHAQA71.5°170.4°
HABCABHABAHABB120.0°119.9°
HACCACHACAHACB120.0°120.0°
CAQCAPHAPHAPA116.8°120.5°
CAPCAQCBAHAQ120.0°119.6°
CAPCAQCBAHAQA116.8°119.8°
CAPCAQHAQHAQA117.1°120.5°
CAPCAQCBACAY32.3°51.2°
CAPCAQCBACAD150.7°69.1°
CAPCAQCBACAE91.2°171.4°
HAPCAPCAQCBA74.7°170.4°
HAPCAPCAQHAQ45.3°69.9°
HAPCAPCAQHAQA168.5°50.6°
HAPACAPCAQCBA161.6°49.8°
HAPACAPCAQHAQ78.4°169.5°
HAPACAPCAQHAQA44.8°70.0°
CBACAQHAQHAQA117.2°120.6°
CAQCBACAYCAD116.3°120.3°
CAQCBACAYCAE125.2°120.2°
CAQCBACADCAE119.8°119.4°
CAQCBACADHAD120.6°60.1°
CAQCBACADHADA119.4°179.9°
CAQCBACADHADB0.6°60.0°
CAQCBACAEHAE11.7°60.0°
CAQCBACAEHAEA131.7°180.0°
CAQCBACAEHAEB108.3°60.0°
CAQCBACAYCAO169.1°162.2°
HAQCAQCBACAY152.3°68.5°
HAQCAQCBACAD89.3°171.3°
HAQCAQCBACAE28.8°51.8°
HAQACAQCBACAY84.5°170.9°
HAQACAQCBACAD33.9°50.7°
HAQACAQCBACAE152.0°68.8°
CAYCBACADCAE118.0°119.5°
CAYCBACADHAD1.6°61.1°
CAYCBACADHADA118.4°58.9°
CAYCBACADHADB121.6°178.9°
CAYCBACAEHAE138.4°178.9°
CAYCBACAEHAEA101.6°58.9°
CAYCBACAEHAEB18.4°61.1°
CBACAYCAOCAV179.9°179.3°
CBACAYCAOHAO0.1°0.4°
CBACADHADHADA120.0°120.0°
CBACADHADHADB120.0°120.1°
CBACADHADAHADB120.0°120.0°
CADCBACAEHAE103.7°59.4°
CADCBACAEHAEA16.3°60.5°
CADCBACAEHAEB136.3°179.4°
CADCBACAYCAO52.8°77.5°
CAECBACADHAD119.7°179.5°
CAECBACADHADA0.4°60.5°
CAECBACADHADB120.3°59.4°
CBACAEHAEHAEA120.0°120.0°
CBACAEHAEHAEB120.0°120.1°
CBACAEHAEAHAEB120.0°120.0°
CAECBACAYCAO65.7°42.0°
HADCADHADAHADB120.0°120.0°
HAECAEHAEAHAEB120.0°120.0°
CAYCAOCAVHAO180.0°179.8°
CAYCAOCAVCAW179.2°179.8°
CAOCAVCAWCAU104.1°115.0°
CAOCAVCAWCAM73.9°65.3°
HAOCAOCAVCAW0.8°0.0°
CAVCAWCAUCAM178.0°179.8°
CAVCAWCAMCAT179.6°180.0°
CAVCAWCAMHAM0.4°0.0°
CAVCAWCAUCAL179.0°180.0°
CAVCAWCAUOAH1.1°0.0°
CAUCAWCAMCAT1.6°0.2°
CAUCAWCAMHAM178.4°179.8°
CAWCAUCALOAH179.9°180.0°
CAWCAUOAHHOAH152.0°90.1°
CAWCAUCALCAK0.5°0.0°
CAWCAUCALHAL179.5°179.9°
CAWCAMCATHAM180.0°180.0°
CAMCAWCAUCAL1.0°0.2°
CAMCAWCAUOAH179.1°179.8°
CAWCAMCATCAK1.6°0.0°
CAWCAMCATCAJ179.3°179.7°
CAMCATCAKCAL1.1°0.2°
CAMCATCAKCAJ177.5°179.7°
CAMCATCAKHAK179.0°180.0°
CAMCATCAJCAI147.0°179.8°
CAMCATCAJHAJ33.0°0.3°
HAMCAMCATCAK178.4°180.0°
HAMCAMCATCAJ0.7°0.3°
CALCAUOAHHOAH27.9°90.0°
CAUCALCAKHAL180.0°180.0°
CAUCALCAKCAT0.5°0.2°
CAUCALCAKHAK179.5°180.0°
OAHCAUCALCAK179.6°180.0°
OAHCAUCALHAL0.4°0.0°
CALCAKCATHAK180.0°179.8°
CALCAKCATCAJ178.6°180.0°
HALCALCAKCAT179.5°179.7°
HALCALCAKHAK0.5°0.0°
CAKCATCAJCAI30.5°0.0°
CAKCATCAJHAJ149.5°180.0°
HAKCAKCATCAJ1.4°0.3°
CATCAJCAIHAJ180.0°179.9°
CATCAJCAICAR177.7°180.0°
CATCAJCAIHAI2.3°0.0°
CAJCAICARHAI180.0°180.0°
CAJCAICAROAF179.6°0.1°
CAJCAICAROAG0.2°180.0°
HAJCAJCAICAR2.3°0.1°
HAJCAJCAIHAI177.7°180.0°
CAICAROAFOAG179.4°180.0°
CAICAROAGHOAG179.4°180.0°
HAICAICAROAF0.4°180.0°
HAICAICAROAG179.8°0.0°
OAFCAROAGHOAG0.0°0.1°

226262

PDB entries from 2024-10-16

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