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ZX9

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
CAICAGdoub1.38Å1.39ÅAromatic
CAICASsing1.38Å1.39ÅAromatic
CAGCAFsing1.38Å1.39ÅAromatic
CAFCAHdoub1.38Å1.39ÅAromatic
CAHCAJsing1.38Å1.39ÅAromatic
CAJCASdoub1.38Å1.39ÅAromatic
CASCAZsing1.51Å1.53Å
CAZCAXsing1.53Å1.53Å
CAZCARsing1.51Å1.53Å
CAXCAMsing1.54Å1.53Å
CAXCANsing1.55Å1.53Å
CAMCAKsing1.54Å1.53Å
CAKCALsing1.54Å1.53Å
CALCANsing1.55Å1.54Å
CAROABdoub1.21Å1.23Å
CARNAPsing1.35Å1.33Å
NAPCAOsing1.47Å1.47Å
CAOCAYsing1.53Å1.53Å
CAYNAQsing1.47Å1.47Å
CAYCAWsing1.53Å1.53Å
NAQCATsing1.47Å1.47Å
CATCAAsing1.53Å1.53Å
CATCAUsing1.53Å1.53Å
CAUOACsing1.43Å1.43Å
CAUCAVsing1.53Å1.53Å
CAVOADsing1.43Å1.43Å
CAVCAWsing1.53Å1.53Å
CAWOAEsing1.43Å1.43Å
CAIHAIsing1.08Å1.08Å
CAGHAGsing1.08Å1.08Å
CAFHAFsing1.08Å1.08Å
CAHHAHsing1.08Å1.08Å
CAJHAJsing1.08Å1.08Å
CAZHAZsing1.09Å1.10Å
CAXHAXsing1.09Å1.10Å
CAMHAMsing1.09Å1.10Å
CAMHAMAsing1.09Å1.10Å
CAKHAKsing1.09Å1.10Å
CAKHAKAsing1.09Å1.10Å
CALHALsing1.09Å1.10Å
CALHALAsing1.09Å1.10Å
CANHANsing1.09Å1.10Å
CANHANAsing1.09Å1.10Å
NAPHNAPsing0.97Å1.00Å
CAOHAOsing1.09Å1.10Å
CAOHAOAsing1.09Å1.10Å
CAYHAYsing1.09Å1.10Å
NAQHNAQsing1.01Å1.00Å
CATHATsing1.09Å1.10Å
CAAHAAsing1.09Å1.10Å
CAAHAAAsing1.09Å1.10Å
CAAHAABsing1.09Å1.10Å
CAUHAUsing1.09Å1.10Å
OACHOACsing0.97Å0.95Å
CAVHAVsing1.09Å1.10Å
OADHOADsing0.97Å0.95Å
CAWHAWsing1.09Å1.10Å
OAEHOAEsing0.97Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
CAGCAICAS120.8°120.0°
CAICAGCAF118.3°120.0°
CAGCAIHAI119.6°120.0°
CAICAGHAG120.8°120.0°
CAICASCAJ120.7°120.0°
CAICASCAZ116.4°120.0°
CASCAIHAI119.6°120.0°
CAGCAFCAH121.0°120.0°
CAFCAGHAG120.9°120.0°
CAGCAFHAF119.5°120.0°
CAFCAHCAJ120.4°119.9°
CAHCAFHAF119.5°120.0°
CAFCAHHAH119.8°120.0°
CAHCAJCAS118.7°120.0°
CAJCAHHAH119.8°120.0°
CAHCAJHAJ120.6°119.9°
CAJCASCAZ122.8°120.0°
CASCAJHAJ120.6°120.0°
CASCAZCAX119.7°109.5°
CASCAZCAR107.3°109.5°
CASCAZHAZ103.5°109.5°
CAXCAZCAR108.1°109.5°
CAZCAXCAM119.6°110.5°
CAZCAXCAN119.1°110.5°
CAXCAZHAZ102.6°109.5°
CAZCAXHAX91.5°110.5°
CAZCAROAB121.2°119.9°
CAZCARNAP113.0°120.0°
CARCAZHAZ116.1°109.4°
CAMCAXCAN103.3°104.2°
CAXCAMCAK96.3°106.6°
CAMCAXHAX111.2°110.5°
CAXCAMHAM114.1°110.1°
CAXCAMHAMA116.8°110.0°
CAXCANCAL102.1°102.7°
CANCAXHAX111.9°110.6°
CAXCANHAN112.0°110.7°
CAXCANHANA113.5°110.8°
CAMCAKCAL102.9°106.6°
CAKCAMHAM114.1°110.1°
CAKCAMHAMA116.7°110.0°
CAMCAKHAK111.7°110.0°
CAMCAKHAKA113.1°110.0°
CAKCALCAN105.8°104.2°
CALCAKHAK111.7°110.1°
CALCAKHAKA113.2°110.0°
CAKCALHAL110.7°110.4°
CAKCALHALA111.5°110.5°
CANCALHAL110.7°110.5°
CANCALHALA111.5°110.5°
CALCANHAN112.0°110.7°
CALCANHANA113.5°110.8°
OABCARNAP125.7°120.0°
CARNAPCAO123.1°120.0°
CARNAPHNAP118.5°120.0°
NAPCAOCAY105.6°109.5°
CAONAPHNAP118.4°120.0°
NAPCAOHAO110.8°109.4°
NAPCAOHAOA111.6°109.5°
CAOCAYNAQ108.9°109.5°
CAOCAYCAW111.0°109.5°
CAYCAOHAO110.8°109.5°
CAYCAOHAOA111.6°109.5°
CAOCAYHAY109.1°109.5°
NAQCAYCAW110.2°109.5°
CAYNAQCAT108.8°111.2°
NAQCAYHAY109.9°109.4°
CAYNAQHNAQ109.7°111.0°
CAYCAWCAV108.1°109.3°
CAYCAWOAE111.0°109.5°
CAWCAYHAY107.7°109.5°
CAYCAWHAW109.3°109.5°
NAQCATCAA109.5°109.4°
NAQCATCAU110.9°109.6°
CATNAQHNAQ109.7°111.1°
NAQCATHAT109.1°109.5°
CAACATCAU111.1°109.5°
CAACATHAT108.8°109.4°
CATCAAHAA109.5°109.5°
CATCAAHAAA109.5°109.5°
CATCAAHAAB109.4°109.5°
CATCAUOAC109.9°109.5°
CATCAUCAV110.7°109.3°
CAUCATHAT107.4°109.5°
CATCAUHAU108.1°109.5°
OACCAUCAV108.7°109.5°
OACCAUHAU110.1°109.5°
CAUOACHOAC109.5°114.0°
CAUCAVOAD110.0°109.5°
CAUCAVCAW108.4°109.2°
CAVCAUHAU109.3°109.5°
CAUCAVHAV109.8°109.5°
OADCAVCAW109.3°109.5°
OADCAVHAV108.8°109.5°
CAVOADHOAD109.5°114.0°
CAVCAWOAE109.3°109.5°
CAWCAVHAV110.5°109.6°
CAVCAWHAW111.1°109.5°
OAECAWHAW108.1°109.5°
CAWOAEHOAE109.5°114.0°
HAMCAMHAMA99.8°110.1°
HAKCAKHAKA104.5°110.1°
HALCALHALA106.6°110.5°
HANCANHANA104.0°110.8°
HAOCAOHAOA106.5°109.5°
HAACAAHAAA109.5°109.5°
HAACAAHAAB109.5°109.4°
HAAACAAHAAB109.5°109.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
CAGCAICASHAI180.0°179.7°
CAICAGCAFHAG180.0°180.0°
CAICAGCAFCAH0.1°0.1°
CAGCAICASCAJ0.3°0.0°
CAGCAICASCAZ176.1°180.0°
CAICAGCAFHAF179.9°179.9°
CASCAICAGCAF0.1°0.0°
CAICASCAJCAH0.3°0.1°
CAICASCAJCAZ176.2°179.9°
CAICASCAZCAX177.7°120.0°
CAICASCAZCAR54.1°119.9°
CASCAICAGHAG179.9°180.0°
CAICASCAJHAJ179.7°180.0°
CAICASCAZHAZ69.1°0.0°
CAGCAFCAHHAF180.0°180.0°
CAGCAFCAHCAJ0.1°0.0°
CAFCAGCAIHAI179.8°179.7°
CAGCAFCAHHAH179.9°180.0°
CAFCAHCAJHAH180.0°180.0°
CAFCAHCAJCAS0.1°0.0°
CAHCAFCAGHAG179.9°180.0°
CAFCAHCAJHAJ179.9°179.9°
CAHCAJCASHAJ180.0°179.9°
CAHCAJCASCAZ175.9°180.0°
CAJCAHCAFHAF179.9°180.0°
CAJCASCAZCAX1.3°59.9°
CAJCASCAZCAR122.2°60.1°
CAJCASCAIHAI179.6°179.6°
CASCAJCAHHAH180.0°179.9°
CAJCASCAZHAZ114.5°179.9°
CASCAZCAXCAR123.1°120.0°
CASCAZCAXHAZ113.7°120.0°
CASCAZCARHAZ115.1°120.0°
CASCAZCAXCAM94.5°177.1°
CASCAZCAXCAN33.8°62.3°
CASCAZCAROAB43.3°36.6°
CASCAZCARNAP134.7°143.5°
CAZCASCAIHAI3.9°0.3°
CAZCASCAJHAJ4.1°0.1°
CASCAZCAXHAX150.0°60.4°
CAXCAZCARHAZ114.5°120.0°
CAZCAXCAMCAN135.1°118.6°
CAZCAXCAMHAX104.7°122.5°
CAZCAXCANHAX104.8°122.6°
CAZCAXCAMCAK172.0°142.3°
CAZCAXCANCAL172.1°156.6°
CAXCAZCAROAB87.0°83.5°
CAXCAZCARNAP95.0°96.5°
CAZCAXCAMHAM68.0°23.0°
CAZCAXCAMHAMA47.7°98.5°
CAZCAXCANHAN67.9°85.1°
CAZCAXCANHANA49.5°38.3°
CARCAZCAXCAM142.4°62.9°
CARCAZCAXCAN89.3°177.6°
CAZCAROABNAP177.8°179.9°
CAZCARNAPCAO179.6°174.9°
CARCAZCAXHAX26.9°59.7°
CAZCARNAPHNAP0.4°5.1°
CAMCAXCANHAX119.7°118.7°
CAXCAMCAKHAM120.0°119.3°
CAXCAMCAKHAMA124.3°119.2°
CAXCAMCAKCAL48.4°0.0°
CAMCAXCANCAL36.7°38.0°
CAMCAXCAZHAZ19.2°57.1°
CAXCAMHAMHAMA125.3°121.4°
CAXCAMCAKHAK168.4°119.3°
CAXCAMCAKHAKA74.0°119.2°
CAMCAXCANHAN156.7°156.3°
CAMCAXCANHANA86.0°80.3°
CANCAXCAMCAK52.9°23.7°
CAXCANCALCAK5.3°38.0°
CAXCANCALHAN120.0°118.3°
CAXCANCALHANA122.6°118.4°
CANCAXCAZHAZ147.5°57.7°
CANCAXCAMHAM67.1°95.7°
CANCAXCAMHAMA177.1°142.9°
CAXCANCALHAL125.3°156.6°
CAXCANCALHALA116.1°80.7°
CAXCANHANHANA123.0°123.4°
CAMCAKCALHAK120.0°119.2°
CAMCAKCALHAKA122.4°119.2°
CAMCAKCALCAN27.5°23.6°
CAKCAMCAXHAX67.3°95.2°
CAKCAMHAMHAMA125.3°121.4°
CAMCAKHAKHAKA122.7°121.4°
CAMCAKCALHAL92.5°142.3°
CAMCAKCALHALA148.9°95.1°
CAKCALCANHAL120.0°118.6°
CAKCALCANHALA121.4°118.7°
CALCAKCAMHAM71.6°119.3°
CALCAKCAMHAMA172.6°119.2°
CALCAKHAKHAKA122.7°121.5°
CAKCALHALHALA121.5°122.5°
CAKCALCANHAN125.3°156.3°
CAKCALCANHANA117.3°80.3°
CALCANCAXHAX83.0°80.7°
CANCALCAKHAK147.5°95.6°
CANCALCAKHAKA94.9°142.9°
CANCALHALHALA121.5°122.7°
CALCANHANHANA123.0°123.3°
OABCARNAPCAO2.5°5.0°
OABCARCAZHAZ158.5°156.5°
OABCARNAPHNAP177.5°175.0°
CARNAPCAOHNAP180.0°180.0°
CARNAPCAOCAY177.1°180.0°
NAPCARCAZHAZ19.6°23.5°
CARNAPCAOHAO62.9°60.0°
CARNAPCAOHAOA55.7°60.0°
NAPCAOCAYHAO120.0°120.0°
NAPCAOCAYHAOA121.4°120.0°
NAPCAOCAYNAQ110.4°55.0°
NAPCAOCAYCAW128.2°175.0°
NAPCAOHAOHAOA121.5°120.0°
NAPCAOCAYHAY9.6°65.0°
CAOCAYNAQCAW122.0°120.0°
CAOCAYNAQHAY119.4°120.0°
CAOCAYCAWHAY119.4°120.0°
CAOCAYNAQCAT174.4°178.3°
CAOCAYCAWCAV175.7°179.2°
CAOCAYCAWOAE55.9°60.9°
CAYCAONAPHNAP2.9°0.0°
CAYCAOHAOHAOA121.6°120.0°
CAOCAYNAQHNAQ54.4°54.1°
CAOCAYCAWHAW63.3°59.2°
NAQCAYCAWHAY119.9°120.0°
CAYNAQCATHNAQ120.0°124.1°
CAYNAQCATCAA177.2°178.2°
CAYNAQCATCAU59.8°61.7°
NAQCAYCAWCAV63.6°59.2°
NAQCAYCAWOAE176.6°179.1°
NAQCAYCAOHAO9.6°65.0°
NAQCAYCAOHAOA128.2°175.0°
CAYNAQCATHAT58.2°58.3°
NAQCAYCAWHAW57.4°60.8°
CAWCAYNAQCAT63.7°61.7°
CAYCAWCAVCAU58.5°57.7°
CAYCAWCAVOAD178.4°177.6°
CAYCAWCAVOAE120.9°119.9°
CAYCAWCAVHAW119.9°120.0°
CAYCAWOAEHAW119.9°120.1°
CAWCAYCAOHAO111.8°55.0°
CAWCAYCAOHAOA6.7°65.0°
CAWCAYNAQHNAQ176.4°174.1°
CAYCAWCAVHAV61.8°62.2°
CAYCAWOAEHOAE17.8°180.0°
NAQCATCAACAU122.8°120.1°
NAQCATCAAHAT119.1°119.9°
NAQCATCAUHAT119.1°120.0°
NAQCATCAUOAC63.0°60.8°
NAQCATCAUCAV57.1°59.2°
CATNAQCAYHAY54.9°58.3°
NAQCATCAAHAA135.8°60.0°
NAQCATCAAHAAA104.2°180.0°
NAQCATCAAHAAB15.8°60.0°
NAQCATCAUHAU176.8°179.1°
CAACATCAUHAT118.9°119.9°
CAACATCAUOAC59.0°59.2°
CAACATCAUCAV179.2°179.2°
CAACATNAQHNAQ57.2°54.1°
CATCAAHAAHAAA120.0°120.1°
CATCAAHAAHAAB120.0°120.0°
CATCAAHAAAHAAB120.0°120.0°
CAACATCAUHAU61.2°60.8°
CATCAUOACCAV121.3°119.8°
CATCAUOACHAU119.0°120.1°
CATCAUCAVHAU118.9°119.9°
CATCAUCAVOAD175.5°177.5°
CATCAUCAVCAW56.1°57.7°
CAUCATNAQHNAQ179.8°174.2°
CAUCATCAAHAA13.0°60.1°
CAUCATCAAHAAA132.9°60.0°
CAUCATCAAHAAB107.0°179.9°
CATCAUOACHOAC133.9°180.0°
CATCAUCAVHAV64.7°62.3°
OACCAUCAVHAU120.2°120.1°
OACCAUCAVOAD54.6°57.6°
OACCAUCAVCAW64.8°62.3°
OACCAUCATHAT178.0°179.2°
OACCAUCAVHAV174.4°177.8°
CAUCAVOADCAW118.8°119.7°
CAUCAVOADHAV120.4°120.1°
CAUCAVCAWHAV120.4°119.9°
CAUCAVCAWOAE179.5°177.6°
CAVCAUCATHAT61.9°60.8°
CAVCAUOACHOAC104.8°60.2°
CAUCAVOADHOAD68.6°60.0°
CAUCAVCAWHAW61.3°62.3°
OADCAVCAWHAV119.8°120.2°
OADCAVCAWOAE60.7°62.5°
OADCAVCAUHAU65.6°62.5°
OADCAVCAWHAW58.5°57.6°
CAVCAWOAEHAW121.0°120.1°
CAVCAWCAYHAY56.4°60.8°
CAWCAVCAUHAU175.0°177.6°
CAWCAVOADHOAD172.5°179.7°
CAVCAWOAEHOAE136.9°60.2°
OAECAWCAYHAY63.4°59.1°
OAECAWCAVHAV59.1°57.7°
HAICAICAGHAG0.2°0.3°
HAGCAGCAFHAF0.1°0.0°
HAFCAFCAHHAH0.2°0.0°
HAHCAHCAJHAJ0.1°0.0°
HAZCAZCAXHAX96.3°179.6°
HAXCAXCAMHAM172.7°145.5°
HAXCAXCAMHAMA56.9°24.0°
HAXCAXCANHAN37.0°37.5°
HAXCAXCANHANA154.3°160.9°
HAMCAMCAKHAK48.4°0.0°
HAMCAMCAKHAKA166.0°121.4°
HAMACAMCAKHAK67.3°121.5°
HAMACAMCAKHAKA50.2°0.0°
HAKCAKCALHAL27.5°23.0°
HAKCAKCALHALA91.1°145.6°
HAKACAKCALHAL145.1°98.5°
HAKACAKCALHALA26.5°24.1°
HALCALCANHAN114.7°85.1°
HALCALCANHANA2.7°38.3°
HALACALCANHAN3.9°37.6°
HALACALCANHANA121.3°161.0°
HNAPNAPCAOHAO117.1°120.0°
HNAPNAPCAOHAOA124.3°120.0°
HAOCAOCAYHAY129.6°175.0°
HAOACAOCAYHAY111.8°55.0°
HAYCAYNAQHNAQ65.0°65.9°
HAYCAYCAWHAW177.4°179.2°
HNAQNAQCATHAT61.8°65.8°
HATCATCAAHAA105.1°179.9°
HATCATCAAHAAA14.9°60.0°
HATCATCAAHAAB134.9°60.0°
HATCATCAUHAU57.7°59.1°
HAACAAHAAAHAAB120.0°119.9°
HAUCAUOACHOAC14.9°59.9°
HAUCAUCAVHAV54.2°57.6°
HAVCAVOADHOAD51.7°60.1°
HAVCAVCAWHAW178.3°177.8°
HAWCAWOAEHOAE102.1°59.9°

225946

PDB entries from 2024-10-09

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