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Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
COdoub1.21Å1.23Å
CCAsing1.51Å1.51Å
CNASsing1.35Å1.35Å
NCAsing1.46Å1.45Å
NCAGsing1.35Å1.33Å
CACBsing1.53Å1.54Å
CBCAAsing1.53Å1.53Å
CBCACsing1.53Å1.53Å
CBCADsing1.53Å1.53Å
CAGOAHdoub1.22Å1.22Å
CAGNAIsing1.35Å1.33Å
NAICAJsing1.40Å1.37Å
CAJCAKdoub1.39Å1.39ÅAromatic
CAJCAPsing1.39Å1.39ÅAromatic
CAKCALsing1.38Å1.40ÅAromatic
CALCAMdoub1.38Å1.39ÅAromatic
CAMCANsing1.38Å1.40ÅAromatic
CANCAPdoub1.39Å1.40ÅAromatic
CAPOAPsing1.36Å1.37Å
OAPCAQsing1.43Å1.43Å
NASCATsing1.46Å1.46Å
NASCAYsing1.46Å1.47Å
CATCAUsing1.51Å1.52Å
CAUOAVdoub1.21Å1.23Å
CAUNAWsing1.35Å1.33Å
NAWOAXsing1.42Å1.39Å
CAYCAZsing1.53Å1.53Å
CAZCBAsing1.54Å1.53Å
CAZCBDsing1.54Å1.52Å
CBACBBsing1.54Å1.53Å
CBBCBCsing1.55Å1.52Å
CBCCBDsing1.55Å1.53Å
NHNsing0.97Å1.00Å
CAHAsing1.09Å1.10Å
CAAHAAsing1.09Å1.10Å
CAAHAAAsing1.09Å1.10Å
CAAHAABsing1.09Å1.10Å
CACHACsing1.09Å1.10Å
CACHACAsing1.09Å1.10Å
CACHACBsing1.09Å1.10Å
CADHADsing1.09Å1.10Å
CADHADAsing1.09Å1.10Å
CADHADBsing1.09Å1.10Å
NAIHNAIsing0.97Å1.00Å
CAKHAKsing1.08Å1.08Å
CALHALsing1.08Å1.08Å
CAMHAMsing1.08Å1.08Å
CANHANsing1.08Å1.08Å
CAQHAQsing1.09Å1.10Å
CAQHAQAsing1.09Å1.10Å
CAQHAQBsing1.09Å1.10Å
CATHATsing1.09Å1.10Å
CATHATAsing1.09Å1.10Å
NAWHNAWsing0.97Å1.00Å
OAXHOAXsing0.97Å0.95Å
CAYHAYsing1.09Å1.10Å
CAYHAYAsing1.09Å1.10Å
CAZHAZsing1.09Å1.10Å
CBAHBAsing1.09Å1.10Å
CBAHBAAsing1.09Å1.10Å
CBBHBBsing1.09Å1.10Å
CBBHBBAsing1.09Å1.10Å
CBCHBCsing1.09Å1.10Å
CBCHBCAsing1.09Å1.10Å
CBDHBDsing1.09Å1.10Å
CBDHBDAsing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
OCCA117.1°119.9°
OCNAS120.2°120.0°
CACNAS122.7°120.0°
CCAN103.0°109.5°
CCACB114.1°109.5°
CCAHA111.9°109.4°
CNASCAT117.9°120.0°
CNASCAY127.5°120.0°
CANCAG124.3°120.0°
NCACB112.6°109.5°
CANHN117.9°120.0°
NCAHA113.5°109.5°
NCAGOAH121.7°120.0°
NCAGNAI114.5°120.0°
CAGNHN117.8°119.9°
CACBCAA112.6°109.5°
CACBCAC109.9°109.5°
CACBCAD110.8°109.4°
CBCAHA102.1°109.4°
CAACBCAC106.6°109.5°
CAACBCAD109.4°109.5°
CBCAAHAA109.5°109.4°
CBCAAHAAA109.5°109.4°
CBCAAHAAB109.5°109.5°
CACCBCAD107.4°109.4°
CBCACHAC109.5°109.5°
CBCACHACA109.5°109.4°
CBCACHACB109.5°109.4°
CBCADHAD109.5°109.4°
CBCADHADA109.5°109.4°
CBCADHADB109.5°109.5°
OAHCAGNAI123.8°120.0°
CAGNAICAJ127.9°120.0°
CAGNAIHNAI116.1°119.9°
NAICAJCAK122.9°120.1°
NAICAJCAP117.9°120.1°
CAJNAIHNAI116.1°120.0°
CAKCAJCAP119.2°119.8°
CAJCAKCAL120.5°120.0°
CAJCAKHAK119.7°120.0°
CAJCAPCAN120.6°119.8°
CAJCAPOAP119.3°120.1°
CAKCALCAM120.2°120.2°
CALCAKHAK119.8°120.0°
CAKCALHAL119.9°119.9°
CALCAMCAN119.5°120.2°
CAMCALHAL119.9°119.9°
CALCAMHAM120.3°119.9°
CAMCANCAP120.0°120.0°
CANCAMHAM120.2°119.9°
CAMCANHAN120.0°120.1°
CANCAPOAP120.0°120.1°
CAPCANHAN120.0°120.0°
CAPOAPCAQ119.6°117.0°
OAPCAQHAQ109.5°109.5°
OAPCAQHAQA109.5°109.5°
OAPCAQHAQB109.4°109.5°
CATNASCAY114.6°120.0°
NASCATCAU113.6°109.5°
NASCATHAT108.1°109.5°
NASCATHATA108.1°109.5°
NASCAYCAZ109.7°109.5°
NASCAYHAY109.4°109.5°
NASCAYHAYA109.4°109.5°
CATCAUOAV122.8°120.0°
CATCAUNAW114.0°120.0°
CAUCATHAT108.1°109.4°
CAUCATHATA108.1°109.5°
OAVCAUNAW123.3°120.0°
CAUNAWOAX122.4°120.0°
CAUNAWHNAW118.8°120.0°
OAXNAWHNAW118.8°120.0°
NAWOAXHOAX109.5°114.0°
CAYCAZCBA109.8°110.0°
CAYCAZCBD113.6°110.1°
CAZCAYHAY109.4°109.5°
CAZCAYHAYA109.4°109.4°
CAYCAZHAZ105.0°110.0°
CBACAZCBD104.6°106.6°
CAZCBACBB106.7°106.6°
CBACAZHAZ113.9°110.0°
CAZCBAHBA110.4°110.1°
CAZCBAHBAA110.4°110.0°
CAZCBDCBC106.1°104.3°
CBDCAZHAZ110.2°110.1°
CAZCBDHBD110.6°110.5°
CAZCBDHBDA110.6°110.5°
CBACBBCBC107.3°104.2°
CBBCBAHBA110.4°110.0°
CBBCBAHBAA110.4°110.0°
CBACBBHBB110.2°110.5°
CBACBBHBBA110.2°110.5°
CBBCBCCBD106.5°102.7°
CBCCBBHBB110.2°110.5°
CBCCBBHBBA110.2°110.5°
CBBCBCHBC110.5°110.7°
CBBCBCHBCA110.5°110.7°
CBDCBCHBC110.5°110.7°
CBDCBCHBCA110.4°110.8°
CBCCBDHBD110.6°110.5°
CBCCBDHBDA110.6°110.5°
HAACAAHAAA109.5°109.5°
HAACAAHAAB109.5°109.5°
HAAACAAHAAB109.5°109.5°
HACCACHACA109.4°109.5°
HACCACHACB109.5°109.5°
HACACACHACB109.5°109.5°
HADCADHADA109.4°109.5°
HADCADHADB109.5°109.5°
HADACADHADB109.5°109.5°
HAQCAQHAQA109.5°109.5°
HAQCAQHAQB109.5°109.5°
HAQACAQHAQB109.5°109.5°
HATCATHATA110.8°109.5°
HAYCAYHAYA109.5°109.5°
HBACBAHBAA108.5°110.1°
HBBCBBHBBA108.8°110.5°
HBCCBCHBCA108.5°110.8°
HBDCBDHBDA108.3°110.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
OCCANAS179.0°179.7°
OCCAN39.0°49.2°
OCCACB83.4°70.9°
OCNASCAT1.1°174.2°
OCNASCAY179.4°5.8°
OCCAHA161.2°169.2°
CCANCB123.4°120.1°
CCANHA121.2°120.0°
CCANCAG114.0°155.0°
CCACBHA121.0°120.0°
CCACBCAA65.1°54.8°
CCACBCAC176.3°174.9°
CCACBCAD57.7°65.2°
CACNASCAT179.9°5.5°
CACNASCAY0.5°174.5°
CCANHN66.0°25.0°
NASCCAN140.0°131.1°
NASCCACB97.6°108.9°
CNASCATCAY179.5°180.0°
CNASCATCAU120.6°96.9°
CNASCAYCAZ89.5°90.0°
NASCCAHA17.8°11.1°
CNASCATHAT0.6°143.1°
CNASCATHATA119.4°23.1°
CNASCAYHAY30.6°150.0°
CNASCAYHAYA150.5°29.9°
CANCAGHN180.0°180.0°
NCACBHA122.1°120.0°
NCACBCAA51.8°174.9°
NCACBCAC66.8°65.1°
NCACBCAD174.6°54.9°
CANCAGOAH2.5°0.0°
CANCAGNAI178.1°180.0°
CAGNCACB122.6°85.0°
NCAGOAHNAI179.3°180.0°
NCAGNAICAJ179.5°174.9°
CAGNCAHA7.2°35.0°
NCAGNAIHNAI0.5°5.1°
CACBCAACAC120.5°120.0°
CACBCAACAD123.7°119.9°
CACBCACCAD120.6°120.0°
CBCANHN57.4°95.1°
CACBCAAHAA180.0°55.3°
CACBCAAHAAA60.0°175.3°
CACBCAAHAAB60.0°64.7°
CACBCACHAC180.0°60.0°
CACBCACHACA60.0°180.0°
CACBCACHACB60.0°60.1°
CACBCADHAD180.0°60.0°
CACBCADHADA60.0°180.0°
CACBCADHADB60.0°60.0°
CAACBCACCAD117.1°120.0°
CAACBCAHA173.9°65.1°
CBCAAHAAHAAA120.0°119.9°
CBCAAHAAHAAB120.0°120.1°
CBCAAHAAAHAAB120.0°120.0°
CAACBCACHAC57.8°180.0°
CAACBCACHACA177.8°60.0°
CAACBCACHACB62.2°60.0°
CAACBCADHAD55.3°60.0°
CAACBCADHADA64.7°60.0°
CAACBCADHADB175.3°179.9°
CACCBCAHA55.2°54.9°
CACCBCAAHAA59.5°64.7°
CACCBCAAHAAA60.5°55.2°
CACCBCAAHAAB179.5°175.2°
CBCACHACHACA120.0°120.0°
CBCACHACHACB120.0°120.0°
CBCACHACAHACB120.0°119.9°
CACCBCADHAD60.0°180.0°
CACCBCADHADA179.9°60.1°
CACCBCADHADB60.0°60.0°
CADCBCAHA63.3°174.9°
CADCBCAAHAA56.3°175.3°
CADCBCAAHAAA176.3°64.8°
CADCBCAAHAAB63.7°55.2°
CADCBCACHAC59.3°60.0°
CADCBCACHACA60.7°60.1°
CADCBCACHACB179.3°180.0°
CBCADHADHADA120.0°119.9°
CBCADHADHADB120.0°120.0°
CBCADHADAHADB120.0°120.0°
OAHCAGNAICAJ0.1°5.1°
OAHCAGNHN177.5°180.0°
OAHCAGNAIHNAI179.9°174.9°
CAGNAICAJHNAI180.0°180.0°
CAGNAICAJCAK0.7°28.4°
CAGNAICAJCAP179.6°151.9°
NAICAGNHN1.9°0.0°
NAICAJCAKCAP179.7°179.7°
NAICAJCAKCAL179.7°179.9°
NAICAJCAPCAN179.7°179.7°
NAICAJCAPOAP0.6°0.0°
NAICAJCAKHAK0.3°0.0°
CAJCAKCALHAK180.0°179.9°
CAJCAKCALCAM0.2°0.0°
CAKCAJCAPCAN0.0°0.6°
CAKCAJCAPOAP179.7°179.7°
CAKCAJNAIHNAI179.3°151.6°
CAJCAKCALHAL179.8°180.0°
CAPCAJCAKCAL0.0°0.3°
CAJCAPCANCAM0.2°0.6°
CAJCAPCANOAP179.7°179.7°
CAJCAPOAPCAQ127.9°180.0°
CAPCAJNAIHNAI0.4°28.1°
CAPCAJCAKHAK180.0°179.8°
CAJCAPCANHAN179.8°179.8°
CAKCALCAMHAL180.0°180.0°
CAKCALCAMCAN0.4°0.0°
CAKCALCAMHAM179.6°180.0°
CALCAMCANHAM180.0°180.0°
CALCAMCANCAP0.4°0.3°
CAMCALCAKHAK179.8°179.9°
CALCAMCANHAN179.7°180.0°
CAMCANCAPHAN180.0°179.7°
CAMCANCAPOAP179.9°179.7°
CANCAMCALHAL179.6°180.0°
CANCAPOAPCAQ51.8°0.3°
CAPCANCAMHAM179.6°179.7°
OAPCAPCANHAN0.1°0.1°
CAPOAPCAQHAQ180.0°60.0°
CAPOAPCAQHAQA60.0°180.0°
CAPOAPCAQHAQB60.0°60.0°
OAPCAQHAQHAQA120.0°120.0°
OAPCAQHAQHAQB120.0°120.0°
OAPCAQHAQAHAQB120.0°120.0°
NASCATCAUHAT120.0°120.0°
NASCATCAUHATA120.0°120.0°
NASCATCAUOAV37.6°7.5°
NASCATCAUNAW143.2°172.5°
CATNASCAYCAZ91.1°90.0°
NASCATHATHATA118.3°120.0°
CATNASCAYHAY148.9°30.0°
CATNASCAYHAYA29.0°150.0°
CAYNASCATCAU58.9°83.1°
NASCAYCAZHAY120.0°120.1°
NASCAYCAZHAYA120.0°120.0°
NASCAYCAZCBA165.5°175.0°
NASCAYCAZCBD77.9°67.8°
CAYNASCATHAT178.9°36.9°
CAYNASCATHATA61.0°156.9°
NASCAYHAYHAYA119.9°120.0°
NASCAYCAZHAZ42.6°53.7°
CATCAUOAVNAW179.2°180.0°
CATCAUNAWOAX178.6°180.0°
CAUCATHATHATA118.3°120.0°
CATCAUNAWHNAW1.4°0.0°
OAVCAUNAWOAX0.7°0.0°
OAVCAUCATHAT82.4°112.5°
OAVCAUCATHATA157.6°127.6°
OAVCAUNAWHNAW179.3°180.0°
CAUNAWOAXHNAW180.0°180.0°
NAWCAUCATHAT96.8°67.5°
NAWCAUCATHATA23.2°52.5°
CAUNAWOAXHOAX0.3°179.9°
CAYCAZCBACBD122.2°119.3°
CAYCAZCBAHAZ117.4°121.3°
CAYCAZCBDHAZ117.5°121.4°
CAYCAZCBACBB148.6°119.3°
CAYCAZCBDCBC149.5°142.9°
CAZCAYHAYHAYA120.0°119.9°
CAYCAZCBAHBA91.4°121.4°
CAYCAZCBAHBAA28.6°0.1°
CAYCAZCBDHBD29.5°24.2°
CAYCAZCBDHBDA90.5°98.4°
CBACAZCBDHAZ122.8°119.2°
CAZCBACBBHBA120.0°119.3°
CAZCBACBBHBAA120.0°119.2°
CAZCBACBBCBC13.1°23.6°
CBACAZCBDCBC29.8°23.6°
CBACAZCAYHAY45.5°54.9°
CBACAZCAYHAYA74.5°65.0°
CAZCBAHBAHBAA121.1°121.5°
CAZCBACBBHBB106.9°142.3°
CAZCBACBBHBBA133.1°95.0°
CBACAZCBDHBD90.2°95.1°
CBACAZCBDHBDA149.8°142.3°
CBDCAZCBACBB26.4°0.0°
CAZCBDCBCCBB22.0°37.9°
CAZCBDCBCHBD120.0°118.7°
CAZCBDCBCHBDA120.0°118.7°
CBDCAZCAYHAY162.1°172.1°
CBDCAZCAYHAYA42.1°52.2°
CBDCAZCBAHBA146.4°119.2°
CBDCAZCBAHBAA93.6°119.2°
CAZCBDCBCHBC98.0°80.3°
CAZCBDCBCHBCA142.0°156.2°
CAZCBDHBDHBDA121.3°122.6°
CBACBBCBCHBB120.0°118.7°
CBACBBCBCHBBA120.0°118.7°
CBACBBCBCCBD5.4°37.9°
CBBCBACAZHAZ94.0°119.4°
CBBCBAHBAHBAA121.1°121.4°
CBACBBHBBHBBA120.9°122.6°
CBACBBCBCHBC114.6°80.3°
CBACBBCBCHBCA125.4°156.3°
CBBCBCCBDHBC120.0°118.2°
CBBCBCCBDHBCA120.0°118.3°
CBCCBBCBAHBA133.0°95.7°
CBCCBBCBAHBAA106.9°142.9°
CBCCBBHBBHBBA120.8°122.6°
CBBCBCHBCHBCA121.2°123.3°
CBBCBCCBDHBD98.0°80.8°
CBBCBCCBDHBDA142.0°156.6°
CBCCBDCAZHAZ93.0°95.7°
CBDCBCCBBHBB125.4°156.6°
CBDCBCCBBHBBA114.6°80.8°
CBDCBCHBCHBCA121.2°123.4°
CBCCBDHBDHBDA121.4°122.6°
HNNCAHA172.8°145.0°
HAACAAHAAAHAAB120.0°120.0°
HACCACHACAHACB120.0°120.0°
HADCADHADAHADB120.0°120.0°
HAKCAKCALHAL0.2°0.1°
HALCALCAMHAM0.4°0.0°
HAMCAMCANHAN0.4°0.0°
HAQCAQHAQAHAQB120.0°120.0°
HNAWNAWOAXHOAX179.7°0.0°
HAYCAYCAZHAZ77.4°66.4°
HAYACAYCAZHAZ162.6°173.7°
HAZCAZCBAHBA26.0°0.1°
HAZCAZCBAHBAA146.1°121.4°
HAZCAZCBDHBD147.0°145.6°
HAZCAZCBDHBDA27.0°23.1°
HBACBACBBHBB13.1°23.0°
HBACBACBBHBBA107.0°145.7°
HBAACBACBBHBB133.1°98.4°
HBAACBACBBHBBA13.0°24.2°
HBBCBBCBCHBC5.4°38.3°
HBBCBBCBCHBCA114.6°85.0°
HBBACBBCBCHBC125.4°161.0°
HBBACBBCBCHBCA5.4°37.6°
HBCCBCCBDHBD142.0°161.0°
HBCCBCCBDHBDA22.0°38.4°
HBCACBCCBDHBD22.0°37.5°
HBCACBCCBDHBDA98.0°85.0°

223532

PDB entries from 2024-08-07

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