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Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
OAKCBFdoub1.21Å1.27Å
OAACBCdoub1.21Å1.23Å
CBCOAHsing1.34Å1.25Å
CBCCATsing1.51Å1.57Å
CBFOADsing1.34Å1.27Å
CBFCBMsing1.51Å1.54Å
OACCBEdoub1.21Å1.26Å
CATCAWsing1.53Å1.57Å
CAWCBMsing1.53Å1.57Å
CBMNBAsing1.47Å1.48Å
CBECBLsing1.51Å1.55Å
CBEOAJsing1.34Å1.27Å
OALPBNdoub1.48Å1.61Å
CBLCAXsing1.53Å1.55Å
CBLNAZsing1.47Å1.49Å
CAXCAUsing1.53Å1.52Å
NBAPBNsing1.68Å1.68Å
CAUCBGsing1.51Å1.52Å
NCBGsing1.35Å1.34Å
NCAsing1.46Å1.43Å
CBCAsing1.53Å1.49Å
CBCARsing1.53Å1.55Å
CASCARsing1.53Å1.50Å
CASOBBsing1.43Å1.44Å
PBNOBBsing1.61Å1.53Å
PBNOAGsing1.61Å1.47Å
OAFCBHdoub1.22Å1.23Å
CBGOAEdoub1.21Å1.25Å
CACsing1.51Å1.57Å
NAZCBHsing1.35Å1.35Å
CBHCBJsing1.48Å1.43Å
COdoub1.21Å1.25Å
COXTsing1.34Å1.25Å
CBJCAPdoub1.40Å1.41ÅAromatic
CBJCAQsing1.40Å1.42ÅAromatic
CAPCANsing1.38Å1.40ÅAromatic
CAQCAOdoub1.38Å1.41ÅAromatic
CANCBIdoub1.39Å1.41ÅAromatic
CAOCBIsing1.39Å1.41ÅAromatic
CBIFAMsing1.35Å1.61Å
OAHH1sing0.97Å0.95Å
CATH2sing1.09Å1.10Å
CATH3sing1.09Å1.10Å
CAWH4sing1.09Å1.10Å
CAWH5sing1.09Å1.10Å
CBMH6sing1.09Å1.10Å
OADH7sing0.97Å0.95Å
NBAH8sing1.01Å1.00Å
OAGH9sing0.97Å0.95Å
CASH10sing1.09Å1.10Å
CASH11sing1.09Å1.10Å
CARH12sing1.09Å1.10Å
CARH13sing1.09Å1.10Å
CBH14sing1.09Å1.10Å
CBH15sing1.09Å1.10Å
CAH16sing1.09Å1.10Å
OXTH17sing0.97Å0.95Å
NH18sing0.97Å1.00Å
CAUH19sing1.09Å1.10Å
CAUH20sing1.09Å1.10Å
CAXH21sing1.09Å1.10Å
CAXH22sing1.09Å1.10Å
CBLH23sing1.09Å1.10Å
OAJH24sing0.97Å0.95Å
NAZH25sing0.97Å1.00Å
CAPH26sing1.08Å1.08Å
CANH27sing1.08Å1.08Å
CAOH28sing1.08Å1.08Å
CAQH29sing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
OAKCBFOAD126.0°120.0°
OAKCBFCBM115.6°120.0°
OAACBCOAH123.3°120.0°
OAACBCCAT118.9°120.0°
OAHCBCCAT117.8°120.0°
CBCOAHH1109.5°117.0°
CBCCATCAW112.6°109.5°
CBCCATH2108.7°109.5°
CBCCATH3108.7°109.5°
OADCBFCBM118.3°120.0°
CBFOADH7109.5°117.0°
CBFCBMCAW108.6°109.5°
CBFCBMNBA111.2°109.4°
CBFCBMH6108.8°109.4°
OACCBECBL116.2°120.0°
OACCBEOAJ126.5°120.0°
CATCAWCBM109.6°109.5°
CAWCATH2108.7°109.5°
CAWCATH3108.7°109.5°
CATCAWH4109.4°109.5°
CATCAWH5109.4°109.5°
CAWCBMNBA110.2°109.5°
CBMCAWH4109.5°109.5°
CBMCAWH5109.4°109.4°
CAWCBMH6108.5°109.5°
CBMNBAPBN117.7°111.0°
NBACBMH6109.6°109.5°
CBMNBAH8107.4°111.0°
CBLCBEOAJ117.3°120.0°
CBECBLCAX106.9°109.5°
CBECBLNAZ111.8°109.5°
CBECBLH23108.7°109.5°
CBEOAJH24109.5°117.0°
OALPBNNBA105.9°109.5°
OALPBNOBB111.0°109.5°
OALPBNOAG113.9°109.4°
CAXCBLNAZ111.0°109.5°
CBLCAXCAU110.9°109.5°
CBLCAXH21109.1°109.5°
CBLCAXH22109.1°109.4°
CAXCBLH23108.8°109.5°
CBLNAZCBH122.3°120.0°
NAZCBLH23109.5°109.5°
CBLNAZH25118.9°120.0°
CAXCAUCBG109.4°109.5°
CAXCAUH19109.5°109.5°
CAXCAUH20109.5°109.4°
CAUCAXH21109.1°109.5°
CAUCAXH22109.1°109.4°
NBAPBNOBB108.4°109.5°
NBAPBNOAG111.2°109.5°
PBNNBAH8107.4°111.0°
CAUCBGN113.4°120.0°
CAUCBGOAE121.5°120.0°
CBGCAUH19109.5°109.4°
CBGCAUH20109.5°109.4°
CBGNCA118.2°120.0°
NCBGOAE125.0°119.9°
CBGNH18120.9°120.0°
NCACB110.1°109.5°
NCAC105.7°109.5°
NCAH16111.9°109.5°
CANH18120.9°120.0°
CACBCAR104.2°109.5°
CBCAC108.3°109.4°
CACBH14110.8°109.5°
CACBH15110.8°109.5°
CBCAH16110.9°109.4°
CBCARCAS107.3°109.5°
CBCARH12110.0°109.5°
CBCARH13110.0°109.5°
CARCBH14110.8°109.5°
CARCBH15110.8°109.5°
CARCASOBB111.7°109.4°
CARCASH10108.9°109.5°
CARCASH11108.9°109.5°
CASCARH12110.0°109.5°
CASCARH13110.0°109.5°
CASOBBPBN119.6°123.0°
OBBCASH10108.9°109.5°
OBBCASH11108.9°109.4°
OBBPBNOAG106.3°109.5°
PBNOAGH9109.5°114.0°
OAFCBHNAZ120.7°120.0°
OAFCBHCBJ121.3°120.0°
CACO117.9°120.0°
CACOXT117.0°120.0°
CCAH16109.9°109.5°
NAZCBHCBJ117.9°120.0°
CBHNAZH25118.8°120.0°
CBHCBJCAP118.9°120.1°
CBHCBJCAQ123.8°120.1°
OCOXT125.0°120.0°
COXTH17109.5°117.0°
CAPCBJCAQ117.3°119.7°
CBJCAPCAN122.2°119.9°
CBJCAPH26118.9°120.1°
CBJCAQCAO121.0°119.9°
CBJCAQH29119.5°120.0°
CAPCANCBI119.9°120.1°
CANCAPH26118.9°120.0°
CAPCANH27120.0°119.9°
CAQCAOCBI120.5°120.1°
CAQCAOH28119.7°119.9°
CAOCAQH29119.5°120.1°
CANCBICAO119.1°120.2°
CANCBIFAM119.4°119.9°
CBICANH27120.1°120.0°
CAOCBIFAM121.6°119.9°
CBICAOH28119.7°120.0°
H2CATH3109.4°109.4°
H4CAWH5109.5°109.5°
H10CASH11109.5°109.5°
H12CARH13109.5°109.4°
H14CBH15109.5°109.4°
H19CAUH20109.5°109.5°
H21CAXH22109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
OAKCBFOADCBM177.7°180.0°
OAKCBFCBMCAW79.4°119.9°
OAKCBFCBMNBA159.3°0.0°
OAKCBFCBMH638.5°120.0°
OAKCBFOADH70.0°0.0°
OAACBCOAHCAT180.0°179.9°
OAACBCCATCAW16.0°0.1°
OAACBCOAHH10.0°0.1°
OAACBCCATH2104.5°120.0°
OAACBCCATH3136.5°120.1°
OAHCBCCATCAW164.0°180.0°
OAHCBCCATH275.6°59.9°
OAHCBCCATH343.5°60.0°
CBCCATCAWH2120.5°120.0°
CBCCATCAWH3120.5°120.0°
CBCCATCAWCBM168.5°180.0°
CATCBCOAHH1180.0°180.0°
CBCCATH2H3118.5°119.9°
CBCCATCAWH471.5°60.0°
CBCCATCAWH548.5°60.1°
OADCBFCBMCAW98.5°60.0°
OADCBFCBMNBA22.8°180.0°
OADCBFCBMH6143.6°60.0°
CBFCBMCAWCAT67.0°175.0°
CBFCBMCAWNBA122.0°120.0°
CBFCBMCAWH6118.0°120.0°
CBFCBMNBAH6120.3°119.9°
CBFCBMNBAPBN76.3°95.0°
CBFCBMCAWH4173.0°65.0°
CBFCBMCAWH553.0°55.0°
CBMCBFOADH7177.8°180.0°
CBFCBMNBAH844.9°29.0°
OACCBECBLOAJ178.4°180.0°
OACCBECBLCAX97.0°119.9°
OACCBECBLNAZ141.3°0.0°
OACCBECBLH2320.3°120.0°
OACCBEOAJH240.0°0.0°
CATCAWCBMH4120.0°120.0°
CATCAWCBMH5120.0°119.9°
CATCAWCBMNBA55.0°65.0°
CAWCATH2H3118.6°120.0°
CATCAWH4H5119.9°120.0°
CATCAWCBMH6175.0°55.0°
CAWCBMNBAH6119.3°120.1°
CAWCBMNBAPBN163.3°145.0°
CBMCAWCATH248.0°59.9°
CBMCAWCATH371.0°60.0°
CBMCAWH4H5120.0°120.0°
CAWCBMNBAH875.5°91.0°
CBMNBAPBNOAL20.2°180.0°
CBMNBAPBNH8121.2°124.0°
CBMNBAPBNOBB139.4°60.0°
CBMNBAPBNOAG104.0°60.0°
NBACBMCAWH465.0°55.0°
NBACBMCAWH5174.9°175.0°
CBECBLCAXNAZ122.2°120.0°
CBECBLCAXH23117.3°120.0°
CBECBLNAZH23120.6°120.0°
CBECBLCAXCAU175.8°175.0°
CBECBLNAZCBH147.4°85.0°
CBECBLCAXH2164.0°65.0°
CBECBLCAXH2255.6°55.0°
CBLCBEOAJH24178.2°179.9°
CBECBLNAZH2532.6°95.0°
OAJCBECBLCAX81.4°60.0°
OAJCBECBLNAZ40.3°180.0°
OAJCBECBLH23161.3°60.0°
OALPBNNBAOBB119.2°120.0°
OALPBNNBAOAG124.2°120.0°
OALPBNOBBCAS51.7°50.0°
OALPBNOBBOAG124.4°120.0°
OALPBNNBAH8101.0°56.0°
OALPBNOAGH90.0°180.0°
CAXCBLNAZH23120.1°120.0°
CBLCAXCAUH21120.2°120.0°
CBLCAXCAUH22120.2°120.0°
CBLCAXCAUCBG153.6°180.0°
CAXCBLNAZCBH93.2°155.0°
CBLCAXCAUH1986.4°60.0°
CBLCAXCAUH2033.6°60.0°
CBLCAXH21H22119.4°120.0°
CAXCBLNAZH2586.7°25.0°
NAZCBLCAXCAU62.0°65.0°
CBLNAZCBHOAF3.7°0.2°
CBLNAZCBHH25180.0°180.0°
CBLNAZCBHCBJ179.2°180.0°
NAZCBLCAXH2158.2°55.0°
NAZCBLCAXH22177.8°175.0°
CAXCAUCBGH19120.0°120.1°
CAXCAUCBGH20120.0°120.0°
CAXCAUCBGN130.3°180.0°
CAXCAUCBGOAE51.6°0.0°
CAXCAUH19H20120.1°120.0°
CAUCAXH21H22119.3°120.0°
CAUCAXCBLH2358.6°55.0°
NBAPBNOBBCAS64.2°70.0°
NBAPBNOBBOAG119.6°120.0°
PBNNBACBMH644.0°24.9°
NBAPBNOAGH9119.6°60.0°
CAUCBGNOAE178.0°180.0°
CAUCBGNCA173.4°180.0°
CAUCBGNH186.6°0.0°
CBGCAUH19H20120.0°120.0°
CBGCAUCAXH2133.4°60.0°
CBGCAUCAXH2286.2°60.0°
CBGNCAH18180.0°180.0°
CBGNCACB176.8°155.0°
CBGNCAC60.1°85.0°
CBGNCAH1659.4°35.0°
NCBGCAUH1910.3°60.0°
NCBGCAUH20109.7°60.0°
NCACBC115.1°120.0°
NCACBH16124.3°120.0°
NCACBCAR177.7°65.0°
CANCBGOAE4.7°0.0°
NCACH16120.9°120.1°
NCACO46.3°0.0°
NCACOXT130.4°179.9°
NCACBH1458.5°174.9°
NCACBH1563.2°55.0°
CACBCARH14119.1°120.0°
CACBCARH15119.2°120.0°
CACBCARCAS172.6°180.0°
CBCACH16121.3°120.0°
CBCACO71.6°120.0°
CBCACOXT111.7°60.0°
CACBCARH1267.8°60.0°
CACBCARH1352.9°60.0°
CACBH14H15122.5°120.0°
CBCANH183.2°25.0°
CBCARCASH12119.6°120.1°
CBCARCASH13119.7°120.0°
CBCARCASOBB157.6°180.0°
CARCBCAC67.3°175.0°
CBCARCASH1082.0°60.0°
CBCARCASH1137.3°60.1°
CBCARH12H13121.0°120.0°
CARCBH14H15122.4°120.0°
CARCBCAH1653.3°55.0°
CARCASOBBH10120.3°120.0°
CARCASOBBH11120.3°120.0°
CARCASOBBPBN158.7°180.0°
CARCASH10H11119.0°120.0°
CASCARH12H13121.0°120.0°
CASCARCBH1453.4°60.0°
CASCARCBH1568.3°60.0°
CASOBBPBNOAG176.1°170.0°
OBBCASH10H11119.0°120.0°
OBBCASCARH1238.0°60.0°
OBBCASCARH1382.7°60.0°
OBBPBNNBAH818.2°176.0°
OBBPBNOAGH9122.6°60.1°
PBNOBBCASH1038.4°60.0°
PBNOBBCASH1180.9°60.0°
OAGPBNNBAH8134.8°63.9°
OAFCBHNAZCBJ175.6°179.7°
OAFCBHCBJCAP1.5°0.0°
OAFCBHCBJCAQ179.7°179.7°
OAFCBHNAZH25176.4°179.7°
OAECBGNH18175.3°180.0°
OAECBGCAUH19171.6°120.1°
OAECBGCAUH2068.4°120.0°
CACOOXT176.4°179.9°
CCACBH14173.6°55.0°
CCACBH1551.9°65.0°
CACOXTH17176.4°180.0°
CCANH18119.9°95.0°
NAZCBHCBJCAP174.1°179.7°
NAZCBHCBJCAQ4.7°0.0°
CBHNAZCBLH2326.9°35.0°
CBHCBJCAPCAQ178.9°179.7°
CBHCBJCAPCAN179.2°180.0°
CBHCBJCAQCAO178.8°179.7°
CBJCBHNAZH250.8°0.0°
CBHCBJCAPH260.8°0.0°
CBHCBJCAQH291.2°0.0°
OCCAH16167.2°120.1°
OCOXTH170.0°0.1°
OXTCCAH169.5°60.0°
CBJCAPCANH26180.0°180.0°
CAPCBJCAQCAO0.0°0.5°
CBJCAPCANCBI0.6°0.1°
CBJCAPCANH27179.4°180.0°
CAPCBJCAQH29180.0°179.8°
CAQCBJCAPCAN0.3°0.2°
CBJCAQCAOH29180.0°179.7°
CBJCAQCAOCBI0.0°0.5°
CAQCBJCAPH26179.6°179.7°
CBJCAQCAOH28180.0°179.7°
CAPCANCBIH27180.0°180.0°
CAPCANCBICAO0.6°0.1°
CAPCANCBIFAM179.8°180.0°
CAQCAOCBICAN0.2°0.3°
CAQCAOCBIH28180.0°179.7°
CAQCAOCBIFAM179.9°179.7°
CANCBICAOFAM179.7°179.9°
CBICANCAPH26179.4°180.0°
CANCBICAOH28179.8°180.0°
CAOCBICANH27179.5°180.0°
CBICAOCAQH29180.0°179.8°
FAMCBICANH270.2°0.0°
FAMCBICAOH280.1°0.1°
H2CATCAWH4168.0°180.0°
H2CATCAWH572.0°60.0°
H3CATCAWH449.0°60.0°
H3CATCAWH5169.0°179.9°
H4CAWCBMH654.9°175.0°
H5CAWCBMH665.1°65.0°
H6CBMNBAH8165.2°148.9°
H10CASCARH12158.3°180.0°
H10CASCARH1337.6°60.0°
H11CASCARH1282.3°60.0°
H11CASCARH13157.0°180.0°
H12CARCBH14173.1°180.0°
H12CARCBH1551.4°60.0°
H13CARCBH1466.2°60.0°
H13CARCBH15172.1°180.0°
H14CBCAH1665.8°65.0°
H15CBCAH16172.5°175.0°
H16CANH18120.6°145.0°
H19CAUCAXH21153.3°180.0°
H19CAUCAXH2233.8°60.0°
H20CAUCAXH2186.6°60.0°
H20CAUCAXH22153.8°180.0°
H21CAXCBLH23178.8°175.0°
H22CAXCBLH2361.6°65.0°
H23CBLNAZH25153.2°145.0°
H26CAPCANH270.6°0.0°
H28CAOCAQH290.1°0.0°

219140

PDB entries from 2024-05-01

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