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A1I5X

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
CAVCAUsing1.53Å1.55Å
CAVCAWsing1.53Å1.48Å
CBCARsing1.53Å1.46Å
CBCAsing1.52Å1.56Å
CAUCALsing1.53Å1.60Å
CARCASsing1.53Å1.50Å
CASCATsing1.54Å1.45Å
CAWCAXsing1.53Å1.59Å
CANsing1.47Å1.53Å
CACsing1.51Å1.51Å
NCAMsing1.33Å1.38Å
NCATsing1.47Å1.43Å
OAOCAMdoub1.21Å1.28Å
CAMCAKsing1.51Å1.40Å
CALCAKsing1.53Å1.54Å
CALCAYsing1.53Å1.46Å
CAKCAFsing1.51Å1.42Å
CAXCAYsing1.53Å1.51Å
OCdoub1.21Å1.24Å
COBAsing1.34Å1.33Å
CAFCAAdoub1.38Å1.41ÅAromatic
CAFCAEsing1.38Å1.41ÅAromatic
OBACBCsing1.45Å1.41Å
CAACABsing1.39Å1.40ÅAromatic
CAECADdoub1.39Å1.38ÅAromatic
CBCCBDsing1.53Å1.58Å
CABOAGsing1.36Å1.41Å
CABCACdoub1.39Å1.41ÅAromatic
CADCACsing1.39Å1.38ÅAromatic
CADOAHsing1.36Å1.35Å
CAJOAGsing1.43Å1.43Å
CBDOBEsing1.43Å1.31Å
OBECBGsing1.43Å1.58Å
CACOAIsing1.36Å1.38Å
CBHOAHsing1.43Å1.42Å
CBGCBFsing1.53Å1.56Å
OAICBFsing1.44Å1.55Å
CAUHAUsing1.09Å1.10Å
CAUHB6sing1.09Å1.10Å
CAVHAVsing1.09Å1.10Å
CAVHB7sing1.09Å1.10Å
CAWHAWsing1.09Å1.10Å
CAWHB8sing1.09Å1.10Å
CAXHAXsing1.09Å1.10Å
CAXHB9sing1.09Å1.10Å
CAYHCAsing1.09Å1.10Å
CAYHAYsing1.09Å1.10Å
CALHANsing1.09Å1.10Å
CAKHAMsing1.09Å1.10Å
CATHB5sing1.09Å1.10Å
CATHATsing1.09Å1.10Å
CASHB4sing1.09Å1.10Å
CASHASsing1.09Å1.10Å
CARHB3sing1.09Å1.10Å
CARHARsing1.09Å1.10Å
CBHB1sing1.09Å1.10Å
CBHB2sing1.09Å1.10Å
CAHAsing1.09Å1.10Å
CBCHBCsing1.09Å1.10Å
CBCHCBsing1.09Å1.10Å
CBDHBDsing1.09Å1.10Å
CBDHCCsing1.09Å1.10Å
CBGHBGsing1.09Å1.10Å
CBGHCEsing1.09Å1.10Å
CBFHBFsing1.09Å1.10Å
CBFHCDsing1.09Å1.10Å
CAJHALsing1.09Å1.10Å
CAJHAJsing1.09Å1.10Å
CAJHAKsing1.09Å1.10Å
CAAHAAsing1.08Å1.08Å
CAEHAEsing1.08Å1.08Å
CBHHCGsing1.09Å1.10Å
CBHHBHsing1.09Å1.10Å
CBHHCFsing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
CAUCAVCAW113.1°109.5°
CAVCAUCAL105.3°109.5°
CAVCAUHAU110.5°109.5°
CAVCAUHB6110.5°109.5°
CAUCAVHAV108.5°109.5°
CAUCAVHB7108.6°109.4°
CAVCAWCAX107.3°109.5°
CAWCAVHAV108.6°109.5°
CAWCAVHB7108.5°109.5°
CAVCAWHAW110.0°109.5°
CAVCAWHB8110.0°109.5°
CARCBCA108.1°111.6°
CBCARCAS111.5°111.4°
CBCARHB3109.0°109.1°
CBCARHAR109.0°109.0°
CARCBHB1109.8°109.0°
CARCBHB2109.8°109.1°
CBCAN113.5°109.6°
CBCAC109.9°110.4°
CACBHB1109.9°109.0°
CACBHB2109.8°109.1°
CBCAHA106.3°109.9°
CAUCALCAK110.3°109.5°
CAUCALCAY112.7°109.4°
CALCAUHAU110.5°109.5°
CALCAUHB6110.5°109.4°
CAUCALHAN106.6°109.5°
CARCASCAT109.9°109.4°
CARCASHB4109.4°109.5°
CARCASHAS109.4°109.5°
CASCARHB3109.0°109.1°
CASCARHAR109.0°109.1°
CASCATN106.3°107.3°
CASCATHB5110.2°109.9°
CASCATHAT110.2°109.9°
CATCASHB4109.4°109.5°
CATCASHAS109.3°109.5°
CAWCAXCAY110.9°109.5°
CAXCAWHAW110.0°109.5°
CAXCAWHB8110.0°109.4°
CAWCAXHAX109.1°109.5°
CAWCAXHB9109.1°109.5°
NCAC113.1°109.2°
CANCAM118.1°118.8°
CANCAT114.8°119.3°
NCAHA106.6°108.5°
CACO123.0°120.1°
CACOBA117.7°119.9°
CCAHA106.9°109.1°
CAMNCAT126.3°121.9°
NCAMOAO116.9°117.8°
NCAMCAK121.8°124.4°
NCATHB5110.2°109.9°
NCATHAT110.3°109.9°
OAOCAMCAK121.0°117.8°
CAMCAKCAL112.9°110.1°
CAMCAKCAF104.6°106.4°
CAMCAKHAM109.7°110.2°
CAKCALCAY111.4°109.5°
CALCAKCAF112.2°110.1°
CAKCALHAN107.3°109.5°
CALCAKHAM108.0°110.0°
CALCAYCAX113.0°109.5°
CALCAYHCA108.6°109.5°
CALCAYHAY108.6°109.4°
CAYCALHAN108.2°109.5°
CAKCAFCAA120.9°119.4°
CAKCAFCAE118.2°120.5°
CAFCAKHAM109.5°110.0°
CAYCAXHAX109.1°109.5°
CAYCAXHB9109.1°109.4°
CAXCAYHCA108.6°109.5°
CAXCAYHAY108.6°109.5°
OCOBA119.3°120.0°
COBACBC111.5°117.4°
CAACAFCAE120.9°120.1°
CAFCAACAB118.6°120.1°
CAFCAAHAA120.7°120.0°
CAFCAECAD119.6°119.9°
CAFCAEHAE120.2°120.0°
OBACBCCBD118.5°109.9°
OBACBCHBC107.2°109.4°
OBACBCHCB107.2°109.4°
CAACABOAG122.5°120.1°
CAACABCAC119.3°119.8°
CABCAAHAA120.7°120.0°
CAECADCAC119.8°119.9°
CAECADOAH126.5°120.0°
CADCAEHAE120.2°120.1°
CBCCBDOBE109.6°109.9°
CBDCBCHBC107.2°109.4°
CBDCBCHCB107.1°109.4°
CBCCBDHBD109.4°109.5°
CBCCBDHCC109.4°109.4°
OAGCABCAC118.1°120.1°
CABOAGCAJ116.8°117.0°
CABCACCAD121.8°119.7°
CABCACOAI122.0°120.0°
CACCADOAH113.7°120.1°
CADCACOAI116.2°120.3°
CADOAHCBH120.4°117.0°
OAGCAJHAL109.5°109.5°
OAGCAJHAJ109.5°109.5°
OAGCAJHAK109.5°109.5°
CBDOBECBG117.6°114.0°
OBECBDHBD109.4°109.4°
OBECBDHCC109.5°109.4°
OBECBGCBF116.7°110.3°
OBECBGHBG107.6°109.3°
OBECBGHCE107.7°109.4°
CACOAICBF118.5°114.1°
OAHCBHHCG109.5°109.5°
OAHCBHHBH109.5°109.5°
OAHCBHHCF109.5°109.4°
CBGCBFOAI110.0°108.5°
CBFCBGHBG107.7°109.3°
CBFCBGHCE107.6°109.4°
CBGCBFHBF109.3°109.6°
CBGCBFHCD109.3°109.6°
OAICBFHBF109.3°109.6°
OAICBFHCD109.3°109.8°
HAUCAUHB6109.4°109.5°
HAVCAVHB7109.4°109.5°
HAWCAWHB8109.4°109.4°
HAXCAXHB9109.4°109.5°
HCACAYHAY109.5°109.4°
HB5CATHAT109.5°109.9°
HB4CASHAS109.5°109.5°
HB3CARHAR109.5°109.1°
HB1CBHB2109.5°109.0°
HBCCBCHCB109.5°109.3°
HBDCBDHCC109.5°109.3°
HBGCBGHCE109.5°109.2°
HBFCBFHCD109.5°109.6°
HALCAJHAJ109.5°109.5°
HALCAJHAK109.5°109.4°
HAJCAJHAK109.4°109.5°
HCGCBHHBH109.5°109.5°
HCGCBHHCF109.5°109.5°
HBHCBHHCF109.5°109.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
CAUCAVCAWHAV120.5°120.0°
CAUCAVCAWHB7120.6°119.9°
CAVCAUCALHAU119.3°120.0°
CAVCAUCALHB6119.3°120.0°
CAUCAVCAWCAX62.2°60.0°
CAVCAUCALCAK179.1°180.0°
CAVCAUCALCAY55.6°60.0°
CAVCAUHAUHB6121.9°120.0°
CAUCAVHAVHB7118.3°120.0°
CAUCAVCAWHAW57.5°60.1°
CAUCAVCAWHB8178.2°180.0°
CAVCAUCALHAN62.9°60.0°
CAWCAVCAUCAL60.9°60.0°
CAVCAWCAXHAW119.7°120.0°
CAVCAWCAXHB8119.7°120.0°
CAVCAWCAXCAY56.4°60.0°
CAWCAVCAUHAU179.7°180.0°
CAWCAVCAUHB658.4°60.0°
CAWCAVHAVHB7118.3°120.0°
CAVCAWHAWHB8121.0°120.0°
CAVCAWCAXHAX176.6°180.0°
CAVCAWCAXHB963.9°60.0°
CARCBCAHB1119.8°120.5°
CARCBCAHB2119.8°120.6°
CBCARCASHB3120.3°120.5°
CBCARCASHAR120.3°120.4°
CBCARCASCAT68.6°61.0°
CARCBCAN43.1°46.1°
CARCBCAC84.7°166.4°
CBCARCASHB4171.3°59.0°
CBCARCASHAS51.5°179.0°
CBCARHB3HAR119.1°119.0°
CARCBHB1HB2120.6°118.9°
CARCBCAHA160.0°73.1°
CACBCARCAS53.5°8.3°
CBCANC126.1°121.1°
CBCANHA116.8°120.0°
CBCACHA115.0°120.9°
CBCANCAM142.6°127.1°
CBCANCAT46.8°54.6°
CBCACO43.0°25.5°
CBCACOBA137.0°154.4°
CACBCARHB366.8°128.8°
CACBCARHAR173.8°112.1°
CACBHB1HB2120.7°119.0°
CAUCALCAKCAM74.6°166.4°
CAUCALCAKCAY126.0°119.9°
CAUCALCAKHAN115.7°120.0°
CAUCALCAYHAN117.6°120.0°
CAUCALCAKCAF167.5°49.4°
CAUCALCAYCAX55.7°60.0°
CALCAUHAUHB6121.9°120.0°
CALCAUCAVHAV178.5°180.0°
CALCAUCAVHB759.6°60.0°
CAUCALCAYHCA176.2°60.0°
CAUCALCAYHAY64.8°180.0°
CAUCALCAKHAM46.8°72.0°
CARCASCATHB4120.1°120.0°
CARCASCATHAS120.1°120.0°
CARCASCATN66.0°54.5°
CARCASCATHB553.5°174.0°
CARCASCATHAT174.5°65.0°
CARCASHB4HAS119.8°120.0°
CASCARHB3HAR119.1°119.1°
CASCARCBHB166.3°112.2°
CASCARCBHB2173.3°128.9°
CASCATNCA56.4°2.8°
CASCATNCAM133.9°179.0°
CASCATNHB5119.5°119.4°
CASCATNHAT119.5°119.5°
CASCATHB5HAT121.4°121.1°
CATCASHB4HAS119.8°120.0°
CATCASCARHB351.8°178.5°
CATCASCARHAR171.1°59.4°
CAWCAXCAYCAL54.8°60.0°
CAWCAXCAYHAX120.2°120.0°
CAWCAXCAYHB9120.2°120.0°
CAXCAWCAVHAV177.3°180.0°
CAXCAWCAVHB758.4°60.0°
CAXCAWHAWHB8121.0°119.9°
CAWCAXHAXHB9119.3°120.0°
CAWCAXCAYHCA175.3°60.1°
CAWCAXCAYHAY65.7°180.0°
NCACHA117.0°118.5°
CANCAMCAT169.5°178.2°
CANCAMOAO0.1°29.1°
CANCAMCAK174.2°150.9°
NCACO170.9°95.0°
NCACOBA9.0°85.0°
CANCATHB563.1°116.7°
CANCATHAT175.8°122.3°
NCACBHB176.7°166.6°
NCACBHB2162.8°74.5°
CCANCAM91.3°6.0°
CCANCAT79.3°175.7°
CACOOBA180.0°180.0°
CACOBACBC163.8°178.5°
CCACBHB1155.6°73.1°
CCACBHB235.1°45.8°
NCAMOAOCAK174.4°180.0°
NCAMCAKCAL158.1°18.8°
NCAMCAKCAF79.7°138.1°
NCAMCAKHAM37.7°102.7°
CAMNCATHB5106.6°61.6°
CAMNCATHAT14.4°59.5°
CAMNCAHA25.8°112.9°
CATNCAMOAO169.5°152.6°
CATNCAMCAK4.8°27.4°
NCATHB5HAT121.5°121.1°
NCATCASHB4173.9°65.5°
NCATCASHAS54.1°174.5°
CATNCAHA163.5°65.4°
OAOCAMCAKCAL27.8°161.2°
OAOCAMCAKCAF94.4°41.9°
OAOCAMCAKHAM148.3°77.3°
CAMCAKCALCAF117.9°117.0°
CAMCAKCALHAM121.5°121.7°
CAMCAKCALCAY159.4°46.4°
CAMCAKCAFHAM117.5°119.4°
CAMCAKCAFCAA114.1°76.3°
CAMCAKCAFCAE64.0°103.5°
CAMCAKCALHAN41.1°73.6°
CAKCALCAYHAN117.7°120.1°
CALCAKCAFHAM119.8°121.4°
CAKCALCAYCAX179.6°180.0°
CALCAKCAFCAA123.2°164.4°
CALCAKCAFCAE58.7°15.7°
CAKCALCAUHAU59.8°60.0°
CAKCALCAUHB661.6°60.0°
CAKCALCAYHCA59.1°60.0°
CAKCALCAYHAY59.8°60.0°
CAYCALCAKCAF41.5°70.5°
CALCAYCAXHCA120.5°120.1°
CALCAYCAXHAY120.5°120.0°
CAYCALCAUHAU175.0°180.0°
CAYCALCAUHB663.7°60.0°
CALCAYCAXHAX175.1°180.0°
CALCAYCAXHB965.4°60.0°
CALCAYHCAHAY118.4°120.0°
CAYCALCAKHAM79.1°168.1°
CAKCAFCAACAE178.0°179.9°
CAKCAFCAACAB176.5°174.7°
CAKCAFCAECAD178.6°174.7°
CAFCAKCALHAN76.8°169.4°
CAKCAFCAAHAA3.5°5.3°
CAKCAFCAEHAE1.5°5.3°
CAYCAXCAWHAW63.3°60.1°
CAYCAXCAWHB8176.0°180.0°
CAYCAXHAXHB9119.3°120.0°
CAXCAYHCAHAY118.4°120.0°
CAXCAYCALHAN61.9°59.9°
OCOBACBC16.2°1.6°
OCCAHA72.0°146.5°
COBACBCCBD178.2°177.1°
OBACCAHA108.0°33.5°
COBACBCHBC60.5°56.9°
COBACBCHCB57.0°62.8°
CAFCAACABHAA180.0°179.9°
CAACAFCAECAD0.5°5.2°
CAFCAACABOAG179.9°179.8°
CAFCAACABCAC3.1°0.3°
CAACAFCAKHAM3.4°43.0°
CAACAFCAEHAE179.5°174.8°
CAECAFCAACAB1.5°5.1°
CAFCAECADHAE180.0°180.0°
CAFCAECADCAC0.9°0.3°
CAFCAECADOAH179.6°179.8°
CAECAFCAKHAM178.5°137.1°
CAECAFCAAHAA178.5°174.8°
OBACBCCBDHBC121.3°120.1°
OBACBCCBDHCB121.3°120.2°
OBACBCCBDOBE55.2°118.9°
OBACBCHBCHCB116.0°119.8°
OBACBCCBDHBD64.8°1.2°
OBACBCCBDHCC175.2°121.0°
CAACABOAGCAC176.8°179.9°
CAACABCACCAD2.8°5.7°
CAACABOAGCAJ61.4°0.1°
CAACABCACOAI176.0°174.7°
CAECADCACCAB0.8°5.7°
CAECADCACOAH179.6°180.0°
CAECADCACOAI178.1°174.7°
CAECADOAHCBH12.1°0.0°
CBCCBDOBEHBD120.0°120.2°
CBCCBDOBEHCC120.0°120.1°
CBCCBDOBECBG179.3°121.7°
CBDCBCHBCHCB115.9°119.8°
CBCCBDHBDHCC119.9°119.9°
OAGCABCACCAD179.7°174.3°
OAGCABCACOAI0.9°5.2°
CABOAGCAJHAL180.0°60.1°
CABOAGCAJHAJ60.0°59.9°
CABOAGCAJHAK60.0°180.0°
OAGCABCAAHAA0.1°0.2°
CABCACCADOAI178.9°179.5°
CABCACCADOAH178.8°174.3°
CACCABOAGCAJ115.3°180.0°
CABCACOAICBF103.3°89.4°
CACCABCAAHAA176.9°179.7°
CACCADOAHCBH168.3°180.0°
CADCACOAICBF77.8°91.0°
CACCADCAEHAE179.2°179.7°
OAHCADCACOAI2.3°5.2°
OAHCADCAEHAE0.4°0.3°
CADOAHCBHHCG180.0°60.0°
CADOAHCBHHBH60.0°60.0°
CADOAHCBHHCF60.0°180.0°
OAGCAJHALHAJ120.0°120.0°
OAGCAJHALHAK120.0°120.0°
OAGCAJHAJHAK120.0°120.0°
CBDOBECBGCBF62.2°174.5°
OBECBDCBCHBC176.5°120.9°
OBECBDCBCHCB66.1°1.2°
OBECBDHBDHCC119.9°119.7°
CBDOBECBGHBG58.8°65.3°
CBDOBECBGHCE176.7°54.2°
OBECBGCBFHBG121.0°120.2°
OBECBGCBFHCE121.1°120.3°
OBECBGCBFOAI81.0°124.3°
CBGOBECBDHBD60.7°1.6°
CBGOBECBDHCC59.2°118.2°
OBECBGHBGHCE116.7°119.6°
OBECBGCBFHBF39.1°116.0°
OBECBGCBFHCD158.9°4.4°
CACOAICBFCBG52.9°25.3°
CACOAICBFHBF67.1°145.0°
CACOAICBFHCD173.0°94.5°
OAHCBHHCGHBH120.0°120.1°
OAHCBHHCGHCF120.0°120.0°
OAHCBHHBHHCF120.0°120.0°
CBGCBFOAIHBF120.1°119.7°
CBGCBFOAIHCD120.1°119.8°
CBFCBGHBGHCE116.7°119.6°
CBGCBFHBFHCD119.7°120.3°
OAICBFCBGHBG158.0°4.1°
OAICBFCBGHCE40.1°115.4°
OAICBFHBFHCD119.8°120.6°
HAUCAUCAVHAV59.1°60.0°
HAUCAUCAVHB759.7°60.0°
HAUCAUCALHAN56.4°60.0°
HB6CAUCAVHAV62.1°60.1°
HB6CAUCAVHB7179.0°179.9°
HB6CAUCALHAN177.7°180.0°
HAVCAVCAWHAW63.0°59.9°
HAVCAVCAWHB857.6°60.0°
HB7CAVCAWHAW178.1°180.0°
HB7CAVCAWHB861.3°60.0°
HAWCAWCAXHAX56.9°60.0°
HAWCAWCAXHB9176.5°180.0°
HB8CAWCAXHAX63.7°60.0°
HB8CAWCAXHB955.8°60.1°
HAXCAXCAYHCA64.4°60.0°
HAXCAXCAYHAY54.5°60.0°
HB9CAXCAYHCA55.1°179.9°
HB9CAXCAYHAY174.1°60.0°
HCACAYCALHAN58.6°180.0°
HAYCAYCALHAN177.6°60.1°
HANCALCAKHAM162.6°48.0°
HB5CATCASHB466.6°54.0°
HB5CATCASHAS173.5°66.0°
HATCATCASHB454.4°175.0°
HATCATCASHAS65.5°55.0°
HB4CASCARHB368.3°61.5°
HB4CASCARHAR51.0°179.4°
HASCASCARHB3171.8°58.5°
HASCASCARHAR68.8°60.6°
HB3CARCBHB1173.4°8.3°
HB3CARCBHB253.0°110.6°
HARCARCBHB154.0°127.4°
HARCARCBHB266.4°8.5°
HB1CBCAHA40.2°47.4°
HB2CBCAHA80.2°166.3°
HBCCBCCBDHBD56.5°119.0°
HBCCBCCBDHCC63.5°0.8°
HCBCBCCBDHBD173.9°121.3°
HCBCBCCBDHCC54.0°118.9°
HBGCBGCBFHBF81.9°123.8°
HBGCBGCBFHCD37.9°115.8°
HCECBGCBFHBF160.2°4.3°
HCECBGCBFHCD80.0°124.7°
HALCAJHAJHAK120.0°120.0°
HCGCBHHBHHCF120.0°120.0°

250835

PDB entries from 2026-03-18

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