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XNM

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
CABCLAAsing1.74Å1.73Å
CAECABdoub1.38Å1.40ÅAromatic
CABCACsing1.38Å1.39ÅAromatic
CADCACdoub1.38Å1.39ÅAromatic
CACHACsing1.08Å1.08Å
CAGCADsing1.39Å1.39ÅAromatic
CADHADsing1.08Å1.08Å
CAFCAEsing1.38Å1.40ÅAromatic
CAEHAEsing1.08Å1.08Å
CAFCAGdoub1.39Å1.40ÅAromatic
CAFHAFsing1.08Å1.08Å
CAHCAGsing1.48Å1.40ÅAromatic
CAPCAHdoub1.40Å1.38ÅAromatic
CAHNAIsing1.33Å1.34ÅAromatic
CAJNAIdoub1.32Å1.48ÅAromatic
NARCAJsing1.33Å1.48ÅAromatic
CAJNAKsing1.39Å1.47Å
NAKCALsing1.39Å1.33Å
NAKHNAKsing0.97Å1.00Å
CALCAMdoub1.39Å1.40ÅAromatic
CALCASsing1.39Å1.39ÅAromatic
CAMCANsing1.38Å1.40ÅAromatic
CAMHAMsing1.08Å1.08Å
CANCAUdoub1.40Å1.40ÅAromatic
CANHANsing1.08Å1.08Å
OAOCAVdoub1.22Å1.23Å
CAQCAPsing1.38Å1.39ÅAromatic
CAPHAPsing1.08Å1.08Å
CAQNARdoub1.32Å1.34ÅAromatic
CAQHAQsing1.08Å1.08Å
CASCATdoub1.38Å1.39ÅAromatic
CASHASsing1.08Å1.08Å
CATCAUsing1.40Å1.39ÅAromatic
CATHATsing1.08Å1.08Å
CAUCAVsing1.48Å1.54Å
CAVNAWsing1.35Å1.35Å
NAWCAXsing1.47Å1.49Å
NAWCAZsing1.47Å1.49Å
CAXCAYsing1.53Å1.54Å
CAXHAXsing1.09Å1.10Å
CAXHAXAsing1.09Å1.10Å
CAYNBBsing1.47Å1.48Å
CAYHAYsing1.09Å1.10Å
CAYHAYAsing1.09Å1.10Å
CAZCBAsing1.53Å1.54Å
CAZHAZsing1.09Å1.10Å
CAZHAZAsing1.09Å1.10Å
CBANBBsing1.47Å1.48Å
CBAHBAsing1.09Å1.10Å
CBAHBAAsing1.09Å1.10Å
NBBCBCsing1.47Å1.48Å
CBCCBDsing1.53Å1.53Å
CBCHBCsing1.09Å1.10Å
CBCHBCAsing1.09Å1.10Å
CBDOBEsing1.43Å1.43Å
CBDHBDsing1.09Å1.10Å
CBDHBDAsing1.09Å1.10Å
OBEHOBEsing0.97Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
CLAACABCAE121.6°119.9°
CLAACABCAC118.0°119.9°
CAECABCAC120.4°120.2°
CABCAECAF120.0°120.1°
CABCAEHAE120.0°120.0°
CABCACCAD119.5°120.1°
CABCACHAC120.3°120.0°
CADCACHAC120.3°119.9°
CACCADCAG120.9°119.9°
CACCADHAD119.5°120.0°
CAGCADHAD119.6°120.1°
CADCAGCAF119.6°119.7°
CADCAGCAH117.7°120.1°
CAFCAEHAE120.0°119.9°
CAECAFCAG119.6°119.9°
CAECAFHAF120.2°120.1°
CAGCAFHAF120.2°120.0°
CAFCAGCAH122.6°120.2°
CAGCAHCAP120.7°120.5°
CAGCAHNAI120.0°120.5°
CAPCAHNAI119.2°119.0°
CAHCAPCAQ119.9°118.4°
CAHCAPHAP120.0°120.8°
CAHNAICAJ123.8°120.6°
NAICAJNAR114.1°121.7°
NAICAJNAK108.3°119.1°
NARCAJNAK108.2°119.2°
CAJNARCAQ118.7°121.0°
CAJNAKCAL124.1°120.0°
CAJNAKHNAK117.9°120.0°
CALNAKHNAK117.9°120.0°
NAKCALCAM123.0°119.9°
NAKCALCAS117.1°119.9°
CAMCALCAS119.9°120.2°
CALCAMCAN120.1°120.1°
CALCAMHAM120.0°120.0°
CALCASCAT120.1°120.0°
CALCASHAS120.0°120.0°
CANCAMHAM119.9°120.0°
CAMCANCAU119.7°119.9°
CAMCANHAN120.1°120.0°
CAUCANHAN120.2°120.0°
CANCAUCAT120.0°119.8°
CANCAUCAV122.0°120.1°
OAOCAVCAU119.4°119.9°
OAOCAVNAW119.4°120.0°
CAQCAPHAP120.1°120.8°
CAPCAQNAR124.3°119.3°
CAPCAQHAQ117.8°120.3°
NARCAQHAQ117.8°120.4°
CATCASHAS119.9°120.0°
CASCATCAU120.3°119.9°
CASCATHAT119.8°120.0°
CAUCATHAT119.8°120.0°
CATCAUCAV118.1°120.1°
CAUCAVNAW121.2°120.0°
CAVNAWCAX121.2°120.9°
CAVNAWCAZ119.7°120.9°
CAXNAWCAZ119.1°118.2°
NAWCAXCAY110.4°108.5°
NAWCAXHAX109.2°109.6°
NAWCAXHAXA109.2°109.6°
NAWCAZCBA111.6°108.5°
NAWCAZHAZ108.8°109.6°
NAWCAZHAZA108.8°109.6°
CAYCAXHAX109.2°109.7°
CAYCAXHAXA109.2°109.7°
CAXCAYNBB112.6°109.4°
CAXCAYHAY108.5°109.5°
CAXCAYHAYA108.4°109.4°
HAXCAXHAXA109.7°109.8°
NBBCAYHAY108.5°109.5°
NBBCAYHAYA108.5°109.5°
CAYNBBCBA116.8°111.4°
CAYNBBCBC112.0°111.0°
HAYCAYHAYA110.4°109.5°
CBACAZHAZ108.8°109.6°
CBACAZHAZA108.8°109.6°
CAZCBANBB113.3°109.3°
CAZCBAHBA108.2°109.5°
CAZCBAHBAA108.2°109.5°
HAZCAZHAZA110.1°109.8°
NBBCBAHBA108.2°109.6°
NBBCBAHBAA108.2°109.4°
CBANBBCBC111.3°111.1°
HBACBAHBAA110.7°109.5°
NBBCBCCBD110.2°109.5°
NBBCBCHBC109.2°109.5°
NBBCBCHBCA109.2°109.4°
CBDCBCHBC109.2°109.5°
CBDCBCHBCA109.2°109.5°
CBCCBDOBE109.8°109.5°
CBCCBDHBD109.3°109.4°
CBCCBDHBDA109.3°109.5°
HBCCBCHBCA109.8°109.5°
OBECBDHBD109.4°109.5°
OBECBDHBDA109.4°109.5°
CBDOBEHOBE109.5°114.0°
HBDCBDHBDA109.6°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
CLAACABCAECAC179.9°179.8°
CLAACABCACCAD180.0°180.0°
CLAACABCACHAC0.0°0.0°
CLAACABCAECAF179.9°180.0°
CLAACABCAEHAE0.0°0.1°
CAECABCACCAD0.1°0.3°
CAECABCACHAC179.9°179.8°
CABCAECAFHAE180.0°179.9°
CABCAECAFCAG0.2°0.1°
CABCAECAFHAF179.8°180.0°
CABCACCADHAC180.0°180.0°
CABCACCADCAG0.3°0.0°
CABCACCADHAD179.7°180.0°
CACCABCAECAF0.1°0.2°
CACCABCAEHAE179.9°179.7°
CACCADCAGHAD180.0°180.0°
CACCADCAGCAF0.4°0.2°
CACCADCAGCAH179.4°180.0°
HACCACCADCAG179.7°180.0°
HACCACCADHAD0.3°0.0°
CADCAGCAFCAE0.4°0.3°
CADCAGCAFCAH179.0°179.7°
CADCAGCAFHAF179.6°179.7°
CADCAGCAHCAP139.9°0.5°
CADCAGCAHNAI38.2°179.7°
HADCADCAGCAF179.6°179.8°
HADCADCAGCAH0.5°0.0°
CAECAFCAGHAF180.0°180.0°
CAECAFCAGCAH179.3°180.0°
HAECAECAFCAG179.8°180.0°
HAECAECAFHAF0.2°0.0°
CAFCAGCAHCAP39.1°179.7°
CAFCAGCAHNAI142.8°0.1°
HAFCAFCAGCAH0.7°0.0°
CAGCAHCAPNAI178.1°179.8°
CAGCAHNAICAJ179.2°180.0°
CAGCAHCAPCAQ179.0°180.0°
CAGCAHCAPHAP1.0°0.0°
CAPCAHNAICAJ1.1°0.2°
CAHCAPCAQHAP180.0°180.0°
CAHCAPCAQNAR0.5°0.1°
CAHCAPCAQHAQ179.4°180.0°
CAHNAICAJNAR0.8°0.1°
CAHNAICAJNAK119.8°180.0°
NAICAHCAPCAQ0.9°0.2°
NAICAHCAPHAP179.1°179.8°
NAICAJNARNAK120.6°179.9°
NAICAJNAKCAL127.2°174.6°
NAICAJNAKHNAK52.8°5.4°
NAICAJNARCAQ0.4°0.4°
NARCAJNAKCAL108.6°5.4°
NARCAJNAKHNAK71.4°174.6°
CAJNARCAQCAP0.3°0.3°
CAJNARCAQHAQ179.7°179.7°
CAJNAKCALHNAK180.0°180.0°
CAJNAKCALCAM7.7°33.5°
CAJNAKCALCAS172.5°146.2°
NAKCAJNARCAQ120.3°179.7°
NAKCALCAMCAS179.8°179.7°
NAKCALCAMCAN179.8°180.0°
NAKCALCAMHAM0.2°0.0°
NAKCALCASCAT179.8°180.0°
NAKCALCASHAS0.2°0.0°
HNAKNAKCALCAM172.3°146.5°
HNAKNAKCALCAS7.5°33.8°
CALCAMCANHAM180.0°180.0°
CALCAMCANCAU0.1°0.0°
CALCAMCANHAN179.9°179.9°
CAMCALCASCAT0.0°0.2°
CAMCALCASHAS180.0°179.7°
CASCALCAMCAN0.1°0.3°
CASCALCAMHAM180.0°179.8°
CALCASCATHAS180.0°179.9°
CALCASCATCAU0.2°0.1°
CALCASCATHAT179.8°179.9°
CAMCANCAUHAN180.0°180.0°
CAMCANCAUCAT0.3°0.2°
CAMCANCAUCAV179.8°180.0°
HAMCAMCANCAU179.9°180.0°
HAMCAMCANHAN0.1°0.0°
CANCAUCAVOAO92.2°45.1°
CANCAUCATCAS0.4°0.3°
CANCAUCATCAV179.5°179.8°
CANCAUCATHAT179.6°179.7°
CANCAUCAVNAW89.0°134.9°
HANCANCAUCAT179.7°179.8°
HANCANCAUCAV0.2°0.0°
OAOCAVCAUCAT87.4°134.7°
OAOCAVCAUNAW178.8°180.0°
OAOCAVNAWCAX179.5°4.0°
OAOCAVNAWCAZ0.4°175.7°
CAPCAQNARHAQ180.0°180.0°
HAPCAPCAQNAR179.4°180.0°
HAPCAPCAQHAQ0.6°0.0°
CASCATCAUHAT180.0°180.0°
CASCATCAUCAV179.9°179.9°
HASCASCATCAU179.8°180.0°
HASCASCATHAT0.2°0.0°
CATCAUCAVNAW91.5°45.4°
HATCATCAUCAV0.1°0.1°
CAUCAVNAWCAX0.7°175.9°
CAUCAVNAWCAZ179.2°4.3°
CAVNAWCAXCAZ179.9°179.7°
CAVNAWCAXCAY176.7°128.8°
CAVNAWCAXHAX63.3°9.1°
CAVNAWCAXHAXA56.7°111.4°
CAVNAWCAZCBA136.8°128.8°
CAVNAWCAZHAZ103.2°111.5°
CAVNAWCAZHAZA16.8°9.1°
NAWCAXCAYHAX120.0°119.7°
NAWCAXCAYHAXA120.0°119.7°
NAWCAXHAXHAXA119.6°120.4°
NAWCAXCAYNBB49.0°53.8°
NAWCAXCAYHAY169.0°66.2°
NAWCAXCAYHAYA71.1°173.8°
CAXNAWCAZCBA43.3°51.4°
CAXNAWCAZHAZ76.6°68.3°
CAXNAWCAZHAZA163.4°171.2°
CAZNAWCAXCAY3.2°51.5°
CAZNAWCAXHAX116.8°171.2°
CAZNAWCAXHAXA123.2°68.3°
NAWCAZCBAHAZ120.0°119.7°
NAWCAZCBAHAZA120.0°119.7°
NAWCAZHAZHAZA119.1°120.5°
NAWCAZCBANBB44.6°53.7°
NAWCAZCBAHBA164.6°173.8°
NAWCAZCBAHBAA75.4°66.1°
CAYCAXHAXHAXA119.6°120.6°
CAXCAYNBBHAY120.0°120.0°
CAXCAYNBBHAYA120.0°119.9°
CAXCAYHAYHAYA118.7°120.0°
CAXCAYNBBCBA48.2°62.9°
CAXCAYNBBCBC81.9°172.7°
HAXCAXCAYNBB71.1°173.5°
HAXCAXCAYHAY49.0°53.5°
HAXCAXCAYHAYA168.9°66.5°
HAXACAXCAYNBB169.0°65.9°
HAXACAXCAYHAY71.0°174.1°
HAXACAXCAYHAYA49.0°54.1°
NBBCAYHAYHAYA118.7°120.1°
CAYNBBCBACAZ0.0°62.8°
CAYNBBCBACBC130.4°124.4°
CAYNBBCBAHBA120.0°177.2°
CAYNBBCBAHBAA120.0°57.1°
CAYNBBCBCCBD126.7°76.0°
CAYNBBCBCHBC113.4°164.0°
CAYNBBCBCHBCA6.7°44.0°
HAYCAYNBBCBA168.2°57.2°
HAYCAYNBBCBC38.1°67.3°
HAYACAYNBBCBA71.8°177.2°
HAYACAYNBBCBC158.1°52.8°
CBACAZHAZHAZA119.2°120.5°
CAZCBANBBHBA120.0°120.0°
CAZCBANBBHBAA120.0°119.9°
CAZCBAHBAHBAA118.4°120.0°
CAZCBANBBCBC130.4°172.8°
HAZCAZCBANBB75.4°66.0°
HAZCAZCBAHBA44.6°54.1°
HAZCAZCBAHBAA164.6°174.1°
HAZACAZCBANBB164.6°173.4°
HAZACAZCBAHBA75.4°66.5°
HAZACAZCBAHBAA44.6°53.6°
NBBCBAHBAHBAA118.4°120.1°
CBANBBCBCCBD100.5°159.4°
CBANBBCBCHBC19.5°39.4°
CBANBBCBCHBCA139.5°80.6°
HBACBANBBCBC109.6°52.8°
HBAACBANBBCBC10.4°67.3°
NBBCBCCBDHBC120.0°120.0°
NBBCBCCBDHBCA120.0°120.0°
NBBCBCHBCHBCA119.7°120.0°
NBBCBCCBDOBE99.4°64.8°
NBBCBCCBDHBD20.6°175.2°
NBBCBCCBDHBDA140.6°55.2°
CBDCBCHBCHBCA119.7°120.0°
CBCCBDOBEHBD120.0°119.9°
CBCCBDOBEHBDA120.0°120.0°
CBCCBDHBDHBDA119.8°120.0°
CBCCBDOBEHOBE180.0°180.0°
HBCCBCCBDOBE140.6°55.2°
HBCCBCCBDHBD99.4°64.8°
HBCCBCCBDHBDA20.6°175.2°
HBCACBCCBDOBE20.6°175.2°
HBCACBCCBDHBD140.6°55.2°
HBCACBCCBDHBDA99.4°64.7°
OBECBDHBDHBDA119.9°120.0°
HBDCBDOBEHOBE60.0°60.1°
HBDACBDOBEHOBE60.0°60.0°

224931

PDB entries from 2024-09-11

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