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7UB

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
CBHOBGsing1.43Å1.43Å
OBGCAVsing1.36Å1.40Å
CAUCAVdoub1.39Å1.39ÅAromatic
CAUCATsing1.38Å1.39ÅAromatic
CAVCAWsing1.39Å1.40ÅAromatic
CATCASdoub1.39Å1.37ÅAromatic
CAWCAXdoub1.38Å1.38ÅAromatic
CASCAXsing1.39Å1.42ÅAromatic
CASNAAsing1.40Å1.44Å
CAFNAAsing1.45Å1.46Å
CAFC5sing1.50Å1.47Å
NAACABsing1.33Å1.45Å
C6C5doub1.39Å1.45ÅAromatic
C6N1sing1.32Å1.35ÅAromatic
C5C4sing1.38Å1.37ÅAromatic
CABOARdoub1.21Å1.17Å
CABCACsing1.49Å1.56Å
N1C2doub1.32Å1.37ÅAromatic
C4CACsing1.50Å1.50Å
C4N3doub1.33Å1.42ÅAromatic
CACCALsing1.54Å1.56Å
CACCAOsing1.54Å1.54Å
CALNAMsing1.49Å1.33Å
C2N3sing1.32Å1.33ÅAromatic
C2NAKsing1.38Å1.41Å
CAOCANsing1.54Å1.39Å
NAKCAQsing1.46Å1.47Å
NAMCANsing1.48Å1.57Å
NAMCAPsing1.47Å1.29Å
CAPCBBsing1.51Å1.56Å
CAQCAYsing1.53Å1.48Å
CAYCBAsing1.53Å1.36Å
CAYCAZsing1.53Å1.36Å
CBBNBCsing1.35Å1.30ÅAromatic
CBBCBFdoub1.35Å1.41ÅAromatic
CBACAZsing1.53Å1.39Å
NBCNBDsing1.40Å1.37ÅAromatic
CBFCBEsing1.40Å1.40ÅAromatic
NBDCBEdoub1.31Å1.32ÅAromatic
C6H1sing1.08Å1.08Å
CAFH2sing1.09Å1.10Å
CAFH3sing1.09Å1.10Å
CALH4sing1.09Å1.10Å
CALH5sing1.09Å1.10Å
CANH6sing1.09Å1.10Å
CANH7sing1.09Å1.10Å
CAOH8sing1.09Å1.10Å
CAOH9sing1.09Å1.10Å
CAPH10sing1.09Å1.10Å
CAPH11sing1.09Å1.10Å
CAQH12sing1.09Å1.10Å
CAQH13sing1.09Å1.10Å
CATH14sing1.08Å1.08Å
CAUH15sing1.08Å1.08Å
CAWH16sing1.08Å1.08Å
CAXH17sing1.08Å1.08Å
CAYH18sing1.09Å1.10Å
CAZH19sing1.09Å1.10Å
CAZH20sing1.09Å1.10Å
CBAH21sing1.09Å1.10Å
CBAH22sing1.09Å1.10Å
CBEH23sing1.08Å1.08Å
CBFH24sing1.08Å1.08Å
CBHH25sing1.09Å1.10Å
CBHH26sing1.09Å1.10Å
CBHH27sing1.09Å1.10Å
NAKH28sing0.97Å1.00Å
NBCH30sing0.97Å1.00Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
CBHOBGCAV118.5°116.9°
OBGCBHH25109.5°109.4°
OBGCBHH26109.5°109.5°
OBGCBHH27109.5°109.5°
OBGCAVCAU120.5°120.0°
OBGCAVCAW117.1°120.0°
CAVCAUCAT117.7°120.0°
CAUCAVCAW122.4°120.0°
CAVCAUH15121.1°120.0°
CAUCATCAS120.0°120.0°
CAUCATH14120.0°120.0°
CATCAUH15121.2°120.0°
CAVCAWCAX119.9°120.1°
CAVCAWH16120.1°120.0°
CATCASCAX122.8°120.0°
CATCASNAA117.9°120.0°
CASCATH14120.0°120.0°
CAWCAXCAS117.1°120.0°
CAXCAWH16120.0°120.0°
CAWCAXH17121.4°120.0°
CAXCASNAA119.2°120.0°
CASCAXH17121.4°120.0°
CASNAACAF111.8°118.2°
CASNAACAB121.8°118.2°
NAACAFC5114.2°112.2°
CAFNAACAB126.3°123.6°
NAACAFH2108.3°109.0°
NAACAFH3108.3°108.9°
CAFC5C6117.6°119.6°
CAFC5C4123.5°121.9°
C5CAFH2108.3°108.7°
C5CAFH3108.3°109.2°
NAACABOAR118.0°118.6°
NAACABCAC117.2°122.7°
C5C6N1116.6°119.3°
C6C5C4118.9°118.6°
C5C6H1121.7°120.3°
C6N1C2121.7°120.7°
N1C6H1121.7°120.4°
C5C4CAC124.2°121.1°
C5C4N3122.8°119.1°
OARCABCAC124.7°118.7°
CABCACC4113.6°112.0°
CABCACCAL102.7°110.3°
CABCACCAO106.3°110.5°
N1C2N3124.8°121.5°
N1C2NAK116.3°119.2°
CACC4N3112.6°119.8°
C4CACCAL121.8°110.2°
C4CACCAO108.5°110.3°
C4N3C2114.9°120.9°
CALCACCAO102.5°103.4°
CACCALNAM111.1°103.2°
CACCALH4109.0°110.6°
CACCALH5109.1°110.7°
CACCAOCAN104.0°105.0°
CACCAOH8110.8°110.4°
CACCAOH9110.8°110.4°
CALNAMCAN104.7°105.9°
CALNAMCAP117.4°111.0°
NAMCALH4109.1°110.7°
NAMCALH5109.1°110.7°
N3C2NAK118.9°119.2°
C2NAKCAQ112.5°120.0°
C2NAKH28108.7°120.0°
CAOCANNAM107.3°107.0°
CAOCANH6110.0°110.0°
CAOCANH7110.0°109.9°
CANCAOH8110.8°110.3°
CANCAOH9110.9°110.3°
NAKCAQCAY114.1°109.4°
NAKCAQH12108.3°109.4°
NAKCAQH13108.3°109.5°
CAQNAKH28108.7°120.0°
CANNAMCAP118.3°111.0°
NAMCANH6110.0°109.9°
NAMCANH7110.0°110.0°
NAMCAPCBB118.6°109.5°
NAMCAPH10107.1°109.5°
NAMCAPH11107.1°109.5°
CAPCBBNBC123.8°126.1°
CAPCBBCBF127.2°126.1°
CBBCAPH10107.1°109.5°
CBBCAPH11107.1°109.5°
CAQCAYCBA151.1°117.4°
CAQCAYCAZ141.1°117.5°
CAYCAQH12108.3°109.5°
CAYCAQH13108.3°109.5°
CAQCAYH1896.5°115.6°
CBACAYCAZ61.5°60.0°
CAYCBACAZ59.1°60.0°
CBACAYH1897.1°117.5°
CAYCBAH21120.1°117.5°
CAYCBAH22120.2°117.5°
CAYCAZCBA59.3°60.0°
CAZCAYH1897.1°117.5°
CAYCAZH19120.1°117.5°
CAYCAZH20120.1°117.5°
NBCCBBCBF108.8°107.7°
CBBNBCNBD106.5°107.9°
CBBNBCH30126.8°126.0°
CBBCBFCBE107.0°107.9°
CBBCBFH24126.5°126.0°
CBACAZH19120.1°117.5°
CBACAZH20120.1°117.5°
CAZCBAH21120.2°117.6°
CAZCBAH22120.2°117.5°
NBCNBDCBE113.0°108.2°
NBDNBCH30126.8°126.0°
CBFCBENBD104.6°108.2°
CBFCBEH23127.7°125.9°
CBECBFH24126.4°126.0°
NBDCBEH23127.7°125.9°
H2CAFH3109.5°108.8°
H4CALH5109.5°110.7°
H6CANH7109.5°109.9°
H8CAOH9109.5°110.4°
H10CAPH11109.5°109.4°
H12CAQH13109.5°109.5°
H19CAZH20109.5°115.6°
H21CBAH22109.4°115.5°
H25CBHH26109.5°109.5°
H25CBHH27109.5°109.4°
H26CBHH27109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
CBHOBGCAVCAU2.1°180.0°
CBHOBGCAVCAW179.6°0.0°
OBGCBHH25H26120.0°120.0°
OBGCBHH25H27120.0°120.0°
OBGCBHH26H27120.0°120.1°
OBGCAVCAUCAW178.1°180.0°
OBGCAVCAUCAT178.2°180.0°
OBGCAVCAWCAX179.1°180.0°
OBGCAVCAUH151.7°0.0°
OBGCAVCAWH160.9°0.0°
CAVOBGCBHH25180.0°180.0°
CAVOBGCBHH2660.0°60.0°
CAVOBGCBHH2760.0°60.0°
CAVCAUCATH15180.0°180.0°
CAVCAUCATCAS2.8°0.0°
CAUCAVCAWCAX2.7°0.0°
CAVCAUCATH14177.2°179.9°
CAUCAVCAWH16177.3°180.0°
CATCAUCAVCAW3.7°0.0°
CAUCATCASH14180.0°179.9°
CAUCATCASCAX1.0°0.0°
CAUCATCASNAA175.8°179.7°
CAVCAWCAXH16180.0°179.9°
CAVCAWCAXCAS0.8°0.0°
CAWCAVCAUH15176.4°180.0°
CAVCAWCAXH17179.2°179.8°
CATCASCAXCAW0.0°0.0°
CATCASCAXNAA174.7°179.6°
CATCASNAACAF57.8°90.6°
CATCASNAACAB124.8°89.7°
CASCATCAUH15177.3°180.0°
CATCASCAXH17180.0°179.7°
CAWCAXCASH17180.0°179.8°
CAWCAXCASNAA174.7°179.7°
CAXCASNAACAF117.1°89.1°
CAXCASNAACAB60.2°90.6°
CAXCASCATH14179.0°180.0°
CASCAXCAWH16179.2°179.9°
CASNAACAFCAB177.2°179.7°
CASNAACAFC5170.8°159.1°
CASNAACABOAR4.7°0.7°
CASNAACABCAC174.2°178.7°
CASNAACAFH250.1°38.7°
CASNAACAFH368.5°79.9°
NAACASCATH144.2°0.4°
NAACASCAXH175.3°0.1°
NAACAFC5H2120.7°120.6°
NAACAFC5H3120.7°120.8°
NAACAFC5C6178.2°159.8°
NAACAFC5C41.1°20.4°
CAFNAACABOAR178.4°179.0°
CAFNAACABCAC2.7°1.6°
NAACAFH2H3117.9°118.6°
C5CAFNAACAB6.4°21.2°
CAFC5C6C4179.4°179.8°
CAFC5C6N1178.3°179.8°
CAFC5C4CAC7.8°0.3°
CAFC5C4N3179.4°180.0°
CAFC5C6H11.7°0.2°
C5CAFH2H3117.9°118.8°
NAACABOARCAC178.8°179.5°
NAACABCACC45.6°18.9°
NAACABCACCAL127.8°142.0°
NAACABCACCAO124.9°104.3°
CABNAACAFH2127.1°141.6°
CABNAACAFH3114.3°99.8°
C5C6N1H1180.0°180.0°
C5C6N1C25.6°0.1°
C6C5C4CAC172.8°179.9°
C6C5C4N30.1°0.3°
C6C5CAFH257.5°39.3°
C6C5CAFH361.1°79.3°
N1C6C5C42.3°0.0°
C6N1C2N37.1°0.4°
C6N1C2NAK172.6°179.9°
C5C4CACCAB11.0°19.0°
C5C4CACN3173.4°179.7°
C5C4CACCAL112.6°142.1°
C5C4CACCAO129.0°104.4°
C5C4N3C21.0°0.6°
C4C5C6H1177.6°180.0°
C4C5CAFH2121.8°140.9°
C4C5CAFH3119.5°100.5°
OARCABCACC4173.2°160.5°
OARCABCACCAL53.4°37.5°
OARCABCACCAO53.9°76.2°
CABCACC4CAL123.5°123.1°
CABCACC4CAO118.0°123.4°
CABCACC4N3175.6°160.6°
CABCACCALCAO110.2°118.1°
CABCACCALNAM116.5°81.2°
CABCACCAOCAN131.8°96.4°
CABCACCALH4123.2°160.4°
CABCACCALH53.7°37.3°
CABCACCAOH812.7°22.5°
CABCACCAOH9109.1°144.7°
N1C2N3C44.4°0.6°
N1C2N3NAK179.7°179.7°
N1C2NAKCAQ172.4°0.0°
C2N1C6H1174.3°180.0°
N1C2NAKH2852.0°180.0°
C4CACCALCAO121.3°117.8°
C4CACCALNAM115.0°154.8°
CACC4N3C2174.5°179.8°
C4CACCAOCAN105.7°139.4°
C4CACCALH45.2°36.3°
C4CACCALH5124.7°86.8°
C4CACCAOH8135.2°101.8°
C4CACCAOH913.5°20.5°
N3C4CACCAL60.8°37.5°
N3C4CACCAO57.6°76.0°
C4N3C2NAK175.3°179.6°
CACCALNAMH4120.2°118.4°
CACCALNAMH5120.2°118.5°
CALCACCAOCAN24.4°21.6°
CACCALNAMCAN12.3°38.7°
CACCALNAMCAP145.7°159.3°
CACCALH4H5119.2°123.1°
CALCACCAOH894.8°140.4°
CALCACCAOH9143.5°97.3°
CAOCACCALNAM6.3°36.9°
CACCAOCANH8119.1°118.9°
CACCAOCANH9119.1°118.9°
CACCAOCANNAM32.5°1.4°
CAOCACCALH4126.6°81.5°
CAOCACCALH5113.9°155.4°
CACCAOCANH6152.2°120.8°
CACCAOCANH787.1°118.1°
CACCAOH8H9122.5°122.3°
CALNAMCANCAO29.4°25.1°
CALNAMCANCAP132.9°120.6°
CALNAMCAPCBB172.7°170.0°
NAMCALH4H5119.3°123.2°
CALNAMCANH6149.0°144.6°
CALNAMCANH790.3°94.3°
CALNAMCAPH1066.0°50.0°
CALNAMCAPH1151.4°70.0°
N3C2NAKCAQ7.3°179.7°
N3C2NAKH28127.8°0.2°
C2NAKCAQH28120.5°180.0°
C2NAKCAQCAY105.6°180.0°
C2NAKCAQH1215.1°60.0°
C2NAKCAQH13133.7°60.1°
CAOCANNAMH6119.7°119.4°
CAOCANNAMH7119.7°119.4°
CAOCANNAMCAP162.2°145.7°
CAOCANH6H7121.0°121.1°
CANCAOH8H9122.6°122.1°
NAKCAQCAYH12120.7°120.0°
NAKCAQCAYH13120.7°120.0°
NAKCAQCAYCBA39.1°175.0°
NAKCAQCAYCAZ171.5°116.4°
NAKCAQH12H13117.9°120.0°
NAKCAQCAYH1878.5°29.4°
CANNAMCAPCBB60.2°72.5°
CANNAMCALH4107.9°79.7°
CANNAMCALH5132.6°157.2°
NAMCANH6H7121.0°121.2°
NAMCANCAOH886.6°117.5°
NAMCANCAOH9151.7°120.4°
CANNAMCAPH1061.1°167.5°
CANNAMCAPH11178.5°47.5°
NAMCAPCBBH10121.3°120.0°
NAMCAPCBBH11121.3°120.0°
NAMCAPCBBNBC87.3°85.0°
NAMCAPCBBCBF87.8°94.7°
CAPNAMCALH425.5°40.9°
CAPNAMCALH594.0°82.3°
CAPNAMCANH678.1°94.9°
CAPNAMCANH742.6°26.3°
NAMCAPH10H11115.9°120.0°
CAPCBBNBCCBF175.9°179.7°
CAPCBBNBCNBD178.8°180.0°
CAPCBBCBFCBE177.5°180.0°
CBBCAPH10H11115.8°120.0°
CAPCBBCBFH242.5°0.1°
CAPCBBNBCH301.3°0.0°
CAQCAYCBACAZ148.2°107.5°
CAQCAYCBAH18117.5°145.0°
CAQCAYCAZH18109.7°145.1°
CAYCAQH12H13117.9°120.0°
CAQCAYCAZH1994.7°145.1°
CAQCAYCAZH2046.8°0.1°
CAQCAYCBAH2138.9°0.0°
CAQCAYCBAH22102.6°145.0°
CAYCAQNAKH28133.9°0.0°
CBACAYCAZH1894.2°107.5°
CAYCBACAZH21109.2°107.5°
CAYCBACAZH22109.2°107.5°
CBACAYCAQH12159.8°55.0°
CBACAYCAQH1381.6°65.0°
CBACAYCAZH19109.3°107.5°
CBACAYCAZH20109.3°107.5°
CAYCBAH21H22145.2°145.7°
CAZCAYCAQH1267.8°123.6°
CAZCAYCAQH1350.8°3.6°
CAYCAZH19H20145.1°145.7°
CBBNBCNBDH30180.0°180.0°
NBCCBBCBFCBE1.8°0.3°
CBBNBCNBDCBE3.1°0.1°
NBCCBBCAPH10151.4°155.0°
NBCCBBCAPH1134.1°35.1°
NBCCBBCBFH24178.2°179.8°
CBFCBBNBCNBD2.9°0.2°
CBBCBFCBEH24180.0°180.0°
CBBCBFCBENBD0.1°0.2°
CBFCBBCAPH1033.5°25.3°
CBFCBBCAPH11150.8°145.3°
CBBCBFCBEH23179.9°180.0°
CBFCBBNBCH30177.1°179.7°
CBACAZH19H20145.1°145.7°
CAZCBAH21H22145.2°145.7°
NBCNBDCBECBF2.0°0.0°
NBCNBDCBEH23178.0°179.8°
CBFCBENBDH23180.0°179.8°
NBDCBECBFH24179.9°179.9°
CBENBDNBCH30176.9°179.8°
H6CANCAOH833.1°1.9°
H6CANCAOH988.7°120.2°
H7CANCAOH8153.8°123.0°
H7CANCAOH932.0°0.9°
H12CAQCAYH1842.2°90.6°
H12CAQNAKH28105.4°120.0°
H13CAQCAYH18160.8°149.3°
H13CAQNAKH2813.2°120.0°
H14CATCAUH152.7°0.0°
H16CAWCAXH170.8°0.3°
H18CAYCAZH1915.0°0.0°
H18CAYCAZH20156.5°145.0°
H18CAYCBAH21156.4°144.9°
H18CAYCBAH2215.0°0.0°
H19CAZCBAH21141.5°145.0°
H19CAZCBAH220.0°0.0°
H20CAZCBAH210.1°0.0°
H20CAZCBAH22141.4°145.0°
H23CBECBFH240.2°0.1°
H25CBHH26H27120.0°119.9°

246704

PDB entries from 2025-12-24

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