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2XQ

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
CAHCAEdoub1.39Å1.39ÅAromatic
CAHCAXsing1.39Å1.38ÅAromatic
CAECAGsing1.38Å1.38ÅAromatic
CAGNASdoub1.32Å1.32ÅAromatic
NASCAMsing1.32Å1.33ÅAromatic
CAMCAXdoub1.38Å1.41ÅAromatic
CAXCAQsing1.51Å1.53Å
CAQNATsing1.47Å1.46Å
NATCAOsing1.47Å1.47Å
CAOCANsing1.53Å1.53Å
CANCAPsing1.53Å1.58Å
CAPOAUsing1.43Å1.46Å
OAUCBDsing1.36Å1.33Å
CBDCAIsing1.38Å1.40ÅAromatic
CBDCBGdoub1.40Å1.37ÅAromatic
CAICAFdoub1.39Å1.40ÅAromatic
CAFCALsing1.38Å1.41ÅAromatic
CALCBFdoub1.39Å1.41ÅAromatic
CBFOAWsing1.35Å1.38ÅAromatic
CBFCBGsing1.40Å1.38ÅAromatic
OAWCBEsing1.34Å1.35ÅAromatic
CBGCAZsing1.47Å1.41ÅAromatic
CAZCAAsing1.51Å1.57Å
CAZCBEdoub1.34Å1.36ÅAromatic
CBECARsing1.51Å1.38Å
CAROAVsing1.43Å1.49Å
OAVCBCsing1.36Å1.36Å
CBCCAKsing1.39Å1.41ÅAromatic
CBCCBBdoub1.39Å1.41ÅAromatic
CAKCAJdoub1.38Å1.41ÅAromatic
CAJCAYsing1.38Å1.43ÅAromatic
CAYFABsing1.35Å1.37Å
CAYCBAdoub1.39Å1.39ÅAromatic
CBAFACsing1.35Å1.36Å
CBACBBsing1.39Å1.39ÅAromatic
CBBFADsing1.35Å1.37Å
CAHHAHsing1.08Å1.08Å
CAEHAEsing1.08Å1.08Å
CAGHAGsing1.08Å1.08Å
CAMHAMsing1.08Å1.08Å
CAQHAQ1sing1.09Å1.10Å
CAQHAQ2sing1.09Å1.10Å
NATHATsing1.01Å1.00Å
CAOHAO1sing1.09Å1.10Å
CAOHAO2sing1.09Å1.10Å
CANHAN1sing1.09Å1.10Å
CANHAN2sing1.09Å1.10Å
CAPHAP1sing1.09Å1.10Å
CAPHAP2sing1.09Å1.10Å
CAIHAIsing1.08Å1.08Å
CAFHAFsing1.08Å1.08Å
CALHALsing1.08Å1.08Å
CAAHAA1sing1.09Å1.10Å
CAAHAA2sing1.09Å1.10Å
CAAHAA3sing1.09Å1.10Å
CARHAR1sing1.09Å1.10Å
CARHAR2sing1.09Å1.10Å
CAKHAKsing1.08Å1.08Å
CAJHAJsing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
CAECAHCAX115.7°118.4°
CAHCAECAG119.9°119.2°
CAECAHHAH122.2°120.8°
CAHCAEHAE120.1°120.3°
CAHCAXCAM121.7°119.2°
CAHCAXCAQ118.2°120.4°
CAXCAHHAH122.2°120.8°
CAECAGNAS123.7°120.8°
CAGCAEHAE120.0°120.5°
CAECAGHAG118.1°119.6°
CAGNASCAM118.6°121.8°
NASCAGHAG118.1°119.6°
NASCAMCAX120.4°120.7°
NASCAMHAM119.8°119.6°
CAMCAXCAQ120.1°120.4°
CAXCAMHAM119.8°119.6°
CAXCAQNAT112.6°109.5°
CAXCAQHAQ1108.7°109.5°
CAXCAQHAQ2108.7°109.5°
CAQNATCAO110.4°111.0°
NATCAQHAQ1108.7°109.5°
NATCAQHAQ2108.7°109.4°
CAQNATHAT109.2°111.0°
NATCAOCAN111.2°109.5°
CAONATHAT109.2°111.0°
NATCAOHAO1109.0°109.5°
NATCAOHAO2109.0°109.4°
CAOCANCAP113.4°109.4°
CANCAOHAO1109.0°109.5°
CANCAOHAO2109.0°109.5°
CAOCANHAN1108.5°109.5°
CAOCANHAN2108.5°109.5°
CANCAPOAU111.3°109.5°
CAPCANHAN1108.5°109.4°
CAPCANHAN2108.5°109.5°
CANCAPHAP1109.0°109.4°
CANCAPHAP2109.0°109.5°
CAPOAUCBD115.4°117.0°
OAUCAPHAP1109.0°109.5°
OAUCAPHAP2109.0°109.5°
OAUCBDCAI120.3°120.3°
OAUCBDCBG116.6°120.2°
CAICBDCBG123.1°119.5°
CBDCAICAF119.4°120.2°
CBDCAIHAI120.3°119.9°
CBDCBGCBF117.5°120.1°
CBDCBGCAZ134.1°134.4°
CAICAFCAL118.7°120.7°
CAFCAIHAI120.3°119.9°
CAICAFHAF120.6°119.6°
CAFCALCBF119.1°120.1°
CALCAFHAF120.7°119.6°
CAFCALHAL120.4°120.0°
CALCBFOAW132.1°133.4°
CALCBFCBG122.1°119.4°
CBFCALHAL120.4°119.9°
OAWCBFCBG105.7°107.2°
CBFOAWCBE110.5°110.9°
CBFCBGCAZ108.5°105.6°
OAWCBECAZ108.7°110.2°
OAWCBECAR123.8°124.9°
CBGCAZCAA128.9°126.9°
CBGCAZCBE106.6°106.2°
CAACAZCBE124.5°126.9°
CAZCAAHAA1109.5°109.4°
CAZCAAHAA2109.5°109.5°
CAZCAAHAA3109.5°109.5°
CAZCBECAR127.3°124.9°
CBECAROAV103.8°109.5°
CBECARHAR1110.9°109.5°
CBECARHAR2110.9°109.5°
CAROAVCBC118.7°117.0°
OAVCARHAR1110.9°109.5°
OAVCARHAR2110.9°109.4°
OAVCBCCAK120.4°120.0°
OAVCBCCBB118.7°120.0°
CAKCBCCBB120.9°119.9°
CBCCAKCAJ119.0°120.0°
CBCCAKHAK120.5°120.0°
CBCCBBCBA119.7°119.9°
CBCCBBFAD122.3°120.0°
CAKCAJCAY119.7°120.1°
CAJCAKHAK120.5°120.0°
CAKCAJHAJ120.2°119.9°
CAJCAYFAB124.2°120.0°
CAJCAYCBA120.1°120.0°
CAYCAJHAJ120.2°119.9°
FABCAYCBA115.7°120.0°
CAYCBAFAC118.1°120.0°
CAYCBACBB120.6°120.0°
FACCBACBB121.3°120.0°
CBACBBFAD118.0°120.1°
HAQ1CAQHAQ2109.4°109.5°
HAO1CAOHAO2109.5°109.5°
HAN1CANHAN2109.4°109.5°
HAP1CAPHAP2109.4°109.5°
HAA1CAAHAA2109.5°109.5°
HAA1CAAHAA3109.4°109.4°
HAA2CAAHAA3109.5°109.5°
HAR1CARHAR2109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
CAECAHCAXHAH180.0°179.7°
CAHCAECAGHAE180.0°180.0°
CAHCAECAGNAS0.8°0.1°
CAECAHCAXCAM1.2°0.1°
CAECAHCAXCAQ179.6°180.0°
CAHCAECAGHAG179.1°179.9°
CAXCAHCAECAG0.6°0.0°
CAHCAXCAMNAS2.1°0.1°
CAHCAXCAMCAQ179.2°179.9°
CAHCAXCAQNAT17.6°89.9°
CAXCAHCAEHAE179.4°180.0°
CAHCAXCAMHAM177.9°180.0°
CAHCAXCAQHAQ1102.9°150.0°
CAHCAXCAQHAQ2138.1°30.0°
CAECAGNASHAG180.0°179.9°
CAECAGNASCAM1.7°0.1°
CAGCAECAHHAH179.4°179.7°
CAGNASCAMCAX2.2°0.0°
NASCAGCAEHAE179.2°179.9°
CAGNASCAMHAM177.8°180.0°
NASCAMCAXHAM180.0°179.9°
NASCAMCAXCAQ178.7°180.0°
CAMNASCAGHAG178.3°179.9°
CAMCAXCAQNAT163.2°90.0°
CAMCAXCAHHAH178.8°179.8°
CAMCAXCAQHAQ176.3°30.0°
CAMCAXCAQHAQ242.7°150.1°
CAXCAQNATHAQ1120.5°120.0°
CAXCAQNATHAQ2120.5°120.0°
CAXCAQNATCAO178.8°180.0°
CAQCAXCAHHAH0.4°0.3°
CAQCAXCAMHAM1.3°0.0°
CAXCAQHAQ1HAQ2118.5°120.0°
CAXCAQNATHAT61.1°56.0°
CAQNATCAOHAT120.1°124.0°
CAQNATCAOCAN161.9°180.0°
NATCAQHAQ1HAQ2118.6°119.9°
CAQNATCAOHAO177.8°60.0°
CAQNATCAOHAO241.7°60.0°
NATCAOCANHAO1120.3°120.0°
NATCAOCANHAO2120.3°119.9°
NATCAOCANCAP172.9°179.9°
CAONATCAQHAQ158.3°59.9°
CAONATCAQHAQ260.7°60.0°
NATCAOHAO1HAO2119.2°120.0°
NATCAOCANHAN152.3°60.0°
NATCAOCANHAN266.5°60.0°
CAOCANCAPHAN1120.6°120.0°
CAOCANCAPHAN2120.6°120.0°
CAOCANCAPOAU48.0°180.0°
CANCAONATHAT41.8°56.0°
CANCAOHAO1HAO2119.2°120.0°
CAOCANHAN1HAN2118.2°120.0°
CAOCANCAPHAP1168.3°60.0°
CAOCANCAPHAP272.3°60.0°
CANCAPOAUHAP1120.3°119.9°
CANCAPOAUHAP2120.3°120.1°
CANCAPOAUCBD170.2°180.0°
CAPCANCAOHAO166.8°60.1°
CAPCANCAOHAO252.6°60.0°
CAPCANHAN1HAN2118.2°120.0°
CANCAPHAP1HAP2119.1°120.0°
CAPOAUCBDCAI13.2°0.1°
CAPOAUCBDCBG169.0°179.7°
OAUCAPCANHAN172.5°60.1°
OAUCAPCANHAN2168.6°59.9°
OAUCAPHAP1HAP2119.2°120.1°
OAUCBDCAICBG177.7°179.8°
OAUCBDCAICAF176.5°179.9°
OAUCBDCBGCBF175.4°179.6°
OAUCBDCBGCAZ3.1°0.1°
CBDOAUCAPHAP169.5°60.1°
CBDOAUCAPHAP249.9°59.9°
OAUCBDCAIHAI3.6°0.0°
CBDCAICAFHAI180.0°180.0°
CBDCAICAFCAL0.3°0.0°
CAICBDCBGCBF2.4°0.6°
CAICBDCBGCAZ179.1°179.7°
CBDCAICAFHAF179.7°180.0°
CBGCBDCAICAF1.2°0.2°
CBDCBGCBFCAL2.6°0.6°
CBDCBGCBFOAW179.7°179.7°
CBDCBGCBFCAZ178.9°179.8°
CBDCBGCAZCAA0.3°0.0°
CBDCBGCAZCBE178.6°179.3°
CBGCBDCAIHAI178.7°179.8°
CAICAFCALHAF180.0°180.0°
CAICAFCALCBF0.5°0.0°
CAICAFCALHAL179.5°180.0°
CAFCALCBFHAL180.0°179.9°
CAFCALCBFOAW178.0°180.0°
CAFCALCBFCBG1.8°0.3°
CALCAFCAIHAI179.7°179.9°
CALCBFOAWCBG176.7°179.7°
CALCBFOAWCBE179.1°179.9°
CALCBFCBGCAZ178.5°179.6°
CBFCALCAFHAF179.5°179.9°
OAWCBFCBGCAZ1.4°0.1°
CBFOAWCBECAZ2.5°0.6°
CBFOAWCBECAR176.9°180.0°
OAWCBFCALHAL2.0°0.1°
CBGCBFOAWCBE2.4°0.3°
CBFCBGCAZCAA178.9°179.7°
CBFCBGCAZCBE0.0°0.5°
CBGCBFCALHAL178.2°179.7°
OAWCBECAZCBG1.5°0.6°
OAWCBECAZCAA179.6°179.9°
OAWCBECAZCAR174.2°179.4°
OAWCBECAROAV70.8°90.0°
OAWCBECARHAR1170.1°30.0°
OAWCBECARHAR248.3°150.0°
CBGCAZCAACBE178.6°179.1°
CBGCAZCBECAR175.7°179.9°
CBGCAZCAAHAA189.2°90.0°
CBGCAZCAAHAA2150.8°150.0°
CBGCAZCAAHAA330.7°30.0°
CAACAZCBECAR5.4°0.7°
CAZCAAHAA1HAA2120.0°120.0°
CAZCAAHAA1HAA3120.0°120.0°
CAZCAAHAA2HAA3120.0°120.0°
CAZCBECAROAV102.6°90.6°
CBECAZCAAHAA189.4°89.1°
CBECAZCAAHAA230.6°30.9°
CBECAZCAAHAA3150.7°151.0°
CAZCBECARHAR116.5°149.4°
CAZCBECARHAR2138.4°29.3°
CBECAROAVHAR1119.1°120.0°
CBECAROAVHAR2119.1°120.0°
CBECAROAVCBC166.5°179.9°
CBECARHAR1HAR2122.6°120.0°
CAROAVCBCCAK47.3°0.1°
CAROAVCBCCBB134.5°179.7°
OAVCARHAR1HAR2122.6°120.0°
OAVCBCCAKCBB178.1°179.7°
OAVCBCCAKCAJ179.9°179.9°
OAVCBCCBBCBA179.1°179.8°
OAVCBCCBBFAD1.8°0.0°
CBCOAVCARHAR174.4°59.9°
CBCOAVCARHAR247.4°60.1°
OAVCBCCAKHAK0.1°0.0°
CBCCAKCAJHAK180.0°180.0°
CBCCAKCAJCAY0.4°0.1°
CAKCBCCBBCBA2.7°0.5°
CAKCBCCBBFAD180.0°179.7°
CBCCAKCAJHAJ179.6°180.0°
CBBCBCCAKCAJ1.9°0.3°
CBCCBBCBACAY1.9°0.5°
CBCCBBCBAFAC179.1°179.7°
CBCCBBCBAFAD177.5°179.8°
CBBCBCCAKHAK178.0°179.7°
CAKCAJCAYHAJ180.0°179.9°
CAKCAJCAYFAB179.3°180.0°
CAKCAJCAYCBA0.4°0.2°
CAJCAYFABCBA178.9°179.8°
CAJCAYCBAFAC179.4°180.0°
CAJCAYCBACBB0.3°0.1°
CAYCAJCAKHAK179.6°180.0°
FABCAYCBAFAC0.4°0.1°
FABCAYCBACBB178.6°179.7°
FABCAYCAJHAJ0.7°0.1°
CAYCBAFACCBB179.0°179.9°
CAYCBACBBFAD179.3°179.8°
CBACAYCAJHAJ179.6°180.0°
FACCBACBBFAD1.7°0.1°
HAHCAHCAEHAE0.6°0.3°
HAECAECAGHAG0.8°0.1°
HAQ1CAQNATHAT178.5°176.0°
HAQ2CAQNATHAT59.4°64.0°
HATNATCAOHAO1162.0°176.0°
HATNATCAOHAO278.5°64.0°
HAO1CAOCANHAN1172.6°180.0°
HAO1CAOCANHAN253.8°60.0°
HAO2CAOCANHAN168.0°59.9°
HAO2CAOCANHAN2173.2°180.0°
HAN1CANCAPHAP147.8°180.0°
HAN1CANCAPHAP2167.2°60.0°
HAN2CANCAPHAP171.1°60.0°
HAN2CANCAPHAP248.3°180.0°
HAICAICAFHAF0.3°0.0°
HAFCAFCALHAL0.5°0.0°
HAA1CAAHAA2HAA3119.9°120.0°
HAKCAKCAJHAJ0.4°0.1°

222624

PDB entries from 2024-07-17

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