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8VS

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
CBLCBMdoub1.38Å1.39ÅAromatic
CBLCBKsing1.38Å1.38ÅAromatic
CBHNBGsing1.46Å1.46Å
CBMCBNsing1.38Å1.39ÅAromatic
CBJCBKsing1.51Å1.53Å
CBJCBEsing1.53Å1.54Å
CBKCBPdoub1.38Å1.40ÅAromatic
NBGCBFsing1.35Å1.44Å
CBNCBOdoub1.38Å1.39ÅAromatic
CBFOBIdoub1.21Å1.21Å
CBFCBEsing1.51Å1.50Å
CBPCBOsing1.38Å1.38ÅAromatic
CBOBR1sing1.89Å1.91Å
CBENASsing1.46Å1.45Å
NASCsing1.35Å1.46Å
CD1CE1doub1.38Å1.42ÅAromatic
CD1CGsing1.38Å1.41ÅAromatic
COdoub1.21Å1.22Å
CCAsing1.51Å1.52Å
CBCGsing1.51Å1.55Å
CBCAsing1.53Å1.52Å
CE1CZsing1.39Å1.40ÅAromatic
CGCD2doub1.38Å1.40ÅAromatic
CANsing1.46Å1.44Å
NBCCBBsing1.35Å1.44Å
CZCBBsing1.48Å1.55Å
CZCE2doub1.40Å1.40ÅAromatic
CD2CE2sing1.38Å1.42ÅAromatic
CBBOBDdoub1.22Å1.23Å
NCAIsing1.35Å1.49Å
OAQCAIdoub1.21Å1.20Å
CAICAGsing1.51Å1.53Å
CAGCAEsing1.51Å1.54Å
CAGCAHsing1.53Å1.54Å
CANCAHsing1.53Å1.50Å
CANCAMsing1.53Å1.54Å
CAFCAEdoub1.38Å1.43ÅAromatic
CAFCAAsing1.38Å1.39ÅAromatic
CAECADsing1.38Å1.38ÅAromatic
CAHCAJsing1.53Å1.52Å
CAACABdoub1.38Å1.38ÅAromatic
CAMCALsing1.53Å1.53Å
CADCACdoub1.38Å1.39ÅAromatic
CABCACsing1.38Å1.41ÅAromatic
CAJCAKsing1.53Å1.54Å
CALCAKsing1.53Å1.50Å
NH1sing0.97Å1.00Å
CAH2sing1.09Å1.10Å
CBH3sing1.09Å1.10Å
CBH4sing1.09Å1.10Å
CD1H5sing1.08Å1.08Å
CD2H6sing1.08Å1.08Å
CE1H7sing1.08Å1.08Å
CE2H8sing1.08Å1.08Å
CAAH9sing1.08Å1.08Å
CABH10sing1.08Å1.08Å
CACH11sing1.08Å1.08Å
CADH12sing1.08Å1.08Å
CAFH13sing1.08Å1.08Å
CAGH14sing1.09Å1.10Å
CAHH15sing1.09Å1.10Å
CAJH16sing1.09Å1.10Å
CAJH17sing1.09Å1.10Å
CAKH18sing1.09Å1.10Å
CAKH19sing1.09Å1.10Å
CALH20sing1.09Å1.10Å
CALH21sing1.09Å1.10Å
CAMH22sing1.09Å1.10Å
CAMH23sing1.09Å1.10Å
CANH24sing1.09Å1.10Å
CANH25sing1.09Å1.10Å
CBEH26sing1.09Å1.10Å
CBHH27sing1.09Å1.10Å
CBHH28sing1.09Å1.10Å
CBHH29sing1.09Å1.10Å
CBJH30sing1.09Å1.10Å
CBJH31sing1.09Å1.10Å
CBLH32sing1.08Å1.08Å
CBMH33sing1.08Å1.08Å
CBNH34sing1.08Å1.08Å
CBPH35sing1.08Å1.08Å
NASH36sing0.97Å1.00Å
NBCH37sing0.97Å1.00Å
NBCH38sing0.97Å1.00Å
NBGH39sing0.97Å1.00Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
CBMCBLCBK120.1°120.1°
CBLCBMCBN120.1°120.0°
CBMCBLH32119.9°120.0°
CBLCBMH33119.9°120.0°
CBLCBKCBJ119.5°120.0°
CBLCBKCBP119.5°120.0°
CBKCBLH32119.9°120.0°
CBHNBGCBF119.9°120.0°
NBGCBHH27109.5°109.5°
NBGCBHH28109.5°109.5°
NBGCBHH29109.5°109.5°
CBHNBGH39120.0°120.0°
CBMCBNCBO120.0°120.0°
CBNCBMH33119.9°120.0°
CBMCBNH34120.0°120.0°
CBKCBJCBE114.7°109.5°
CBJCBKCBP121.0°120.0°
CBKCBJH30108.2°109.4°
CBKCBJH31108.1°109.4°
CBJCBECBF107.7°109.5°
CBJCBENAS112.2°109.5°
CBJCBEH26109.2°109.5°
CBECBJH30108.2°109.5°
CBECBJH31108.2°109.5°
CBKCBPCBO120.3°120.0°
CBKCBPH35119.8°120.0°
NBGCBFOBI119.8°120.0°
NBGCBFCBE120.1°120.0°
CBFNBGH39120.0°120.0°
CBNCBOCBP119.9°120.0°
CBNCBOBR1120.1°120.0°
CBOCBNH34120.0°120.1°
OBICBFCBE120.1°120.0°
CBFCBENAS107.6°109.5°
CBFCBEH26109.7°109.5°
CBPCBOBR1119.9°120.0°
CBOCBPH35119.8°120.0°
CBENASC119.3°120.0°
NASCBEH26110.4°109.5°
CBENASH36120.4°120.0°
NASCO120.0°120.0°
NASCCA119.9°120.0°
CNASH36120.4°120.0°
CE1CD1CG120.1°120.1°
CD1CE1CZ119.9°119.9°
CE1CD1H5119.9°120.0°
CD1CE1H7120.0°120.0°
CD1CGCB120.3°119.8°
CD1CGCD2119.7°120.3°
CGCD1H5119.9°119.9°
OCCA120.1°120.0°
CCACB110.0°109.5°
CCAN110.8°109.5°
CCAH2108.4°109.4°
CGCBCA110.5°109.5°
CBCGCD2120.0°119.9°
CGCBH3109.2°109.5°
CGCBH4109.2°109.5°
CBCAN109.8°109.5°
CBCAH2108.4°109.4°
CACBH3109.2°109.4°
CACBH4109.2°109.5°
CE1CZCBB120.1°120.2°
CE1CZCE2119.9°119.7°
CZCE1H7120.0°120.1°
CGCD2CE2120.0°120.1°
CGCD2H6120.0°119.9°
CANCAI122.0°120.0°
CANH1119.0°120.0°
NCAH2109.4°109.5°
NBCCBBCZ120.0°120.0°
NBCCBBOBD120.1°120.0°
CBBNBCH37120.0°120.0°
CBBNBCH38120.0°119.9°
CBBCZCE2120.0°120.1°
CZCBBOBD120.0°120.0°
CZCE2CD2120.3°119.8°
CZCE2H8119.9°120.1°
CE2CD2H6120.0°120.0°
CD2CE2H8119.8°120.0°
NCAIOAQ121.0°120.0°
NCAICAG116.3°120.1°
CAINH1119.0°120.0°
OAQCAICAG122.7°120.0°
CAICAGCAE107.1°109.4°
CAICAGCAH116.1°109.5°
CAICAGH14105.5°109.4°
CAECAGCAH116.5°109.5°
CAGCAECAF122.0°120.0°
CAGCAECAD118.5°120.0°
CAECAGH14105.3°109.5°
CAGCAHCAN112.5°109.4°
CAGCAHCAJ115.9°109.5°
CAHCAGH14105.3°109.5°
CAGCAHH15107.0°109.5°
CAHCANCAM108.3°109.5°
CANCAHCAJ106.4°109.5°
CANCAHH15107.4°109.4°
CAHCANH24109.7°109.5°
CAHCANH25109.7°109.5°
CANCAMCAL113.9°109.5°
CANCAMH22108.4°109.5°
CANCAMH23108.4°109.5°
CAMCANH24109.8°109.4°
CAMCANH25109.8°109.5°
CAECAFCAA120.4°120.0°
CAFCAECAD119.4°120.0°
CAECAFH13119.8°120.0°
CAFCAACAB119.8°120.0°
CAFCAAH9120.1°120.0°
CAACAFH13119.8°120.0°
CAECADCAC120.1°120.0°
CAECADH12119.9°120.1°
CAHCAJCAK109.3°109.5°
CAJCAHH15107.2°109.5°
CAHCAJH16109.5°109.5°
CAHCAJH17109.5°109.5°
CAACABCAC119.9°120.0°
CABCAAH9120.1°120.0°
CAACABH10120.1°120.0°
CAMCALCAK115.3°109.5°
CAMCALH20108.0°109.4°
CAMCALH21108.0°109.5°
CALCAMH22108.3°109.5°
CALCAMH23108.3°109.5°
CADCACCAB120.4°120.0°
CADCACH11119.8°120.0°
CACCADH12120.0°120.0°
CACCABH10120.0°120.1°
CABCACH11119.8°120.0°
CAJCAKCAL114.0°109.4°
CAKCAJH16109.5°109.5°
CAKCAJH17109.5°109.5°
CAJCAKH18108.3°109.5°
CAJCAKH19108.3°109.5°
CALCAKH18108.3°109.5°
CALCAKH19108.3°109.5°
CAKCALH20108.0°109.4°
CAKCALH21108.0°109.5°
H3CBH4109.5°109.5°
H16CAJH17109.5°109.4°
H18CAKH19109.5°109.5°
H20CALH21109.4°109.5°
H22CAMH23109.5°109.4°
H24CANH25109.5°109.5°
H27CBHH28109.5°109.5°
H27CBHH29109.5°109.4°
H28CBHH29109.4°109.5°
H30CBJH31109.5°109.5°
H37NBCH38120.0°120.1°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
CBMCBLCBKH32180.0°180.0°
CBLCBMCBNH33180.0°179.9°
CBMCBLCBKCBJ179.3°180.0°
CBMCBLCBKCBP0.8°0.3°
CBLCBMCBNCBO0.2°0.1°
CBLCBMCBNH34179.8°179.9°
CBKCBLCBMCBN0.3°0.0°
CBLCBKCBJCBP178.5°179.7°
CBLCBKCBJCBE111.2°89.7°
CBLCBKCBPCBO0.7°0.5°
CBLCBKCBJH30128.0°150.3°
CBLCBKCBJH319.5°30.3°
CBKCBLCBMH33179.7°180.0°
CBLCBKCBPH35179.3°179.7°
CBHNBGCBFH39180.0°180.0°
CBHNBGCBFOBI0.3°0.0°
CBHNBGCBFCBE179.8°180.0°
NBGCBHH27H28120.0°120.1°
NBGCBHH27H29120.0°120.0°
NBGCBHH28H29120.0°120.0°
CBMCBNCBOH34180.0°180.0°
CBMCBNCBOCBP0.2°0.2°
CBMCBNCBOBR1179.8°180.0°
CBNCBMCBLH32179.7°179.9°
CBKCBJCBEH30120.8°120.0°
CBKCBJCBEH31120.8°120.0°
CBKCBJCBECBF169.1°175.0°
CBJCBKCBPCBO179.2°179.8°
CBKCBJCBENAS50.9°65.0°
CBKCBJCBEH2671.9°55.0°
CBKCBJH30H31117.6°119.9°
CBJCBKCBLH320.7°0.1°
CBJCBKCBPH350.8°0.0°
CBECBJCBKCBP70.3°90.0°
CBJCBECBFNBG73.5°60.0°
CBJCBECBFOBI106.1°120.0°
CBJCBECBFNAS121.2°120.0°
CBJCBECBFH26118.7°120.0°
CBJCBENASH26122.1°120.0°
CBJCBENASC160.3°155.0°
CBECBJH30H31117.7°120.1°
CBJCBENASH3619.7°25.0°
CBKCBPCBOCBN0.3°0.5°
CBKCBPCBOH35180.0°179.7°
CBKCBPCBOBR1179.8°179.7°
CBPCBKCBJH3050.5°30.0°
CBPCBKCBJH31168.9°150.0°
CBPCBKCBLH32179.2°179.8°
NBGCBFOBICBE179.6°180.0°
NBGCBFCBENAS165.3°180.0°
NBGCBFCBEH2645.2°60.0°
CBFNBGCBHH27180.0°180.0°
CBFNBGCBHH2860.0°60.0°
CBFNBGCBHH2960.0°60.0°
CBNCBOCBPBR1180.0°179.8°
CBOCBNCBMH33179.8°180.0°
CBNCBOCBPH35179.8°179.8°
OBICBFCBENAS15.1°0.0°
OBICBFCBEH26135.2°120.0°
OBICBFNBGH39179.7°180.0°
CBFCBENASH26119.6°120.0°
CBFCBENASC81.4°85.0°
CBFCBECBJH3070.1°65.0°
CBFCBECBJH3148.4°55.0°
CBFCBENASH3698.6°95.0°
CBECBFNBGH390.2°0.1°
CBPCBOCBNH34179.8°179.8°
BR1CBOCBNH340.2°0.0°
BR1CBOCBPH350.2°0.1°
CBENASCH36180.0°180.0°
CBENASCO0.6°0.0°
CBENASCCA179.5°180.0°
NASCBECBJH30171.6°55.0°
NASCBECBJH3169.9°175.0°
NASCOCA179.9°180.0°
NASCCACB68.0°60.0°
NASCCAN170.4°180.0°
NASCCAH250.3°60.0°
CNASCBEH2638.3°35.0°
CE1CD1CGH5180.0°179.9°
CE1CD1CGCB179.9°180.0°
CD1CE1CZH7180.0°179.9°
CE1CD1CGCD20.1°0.3°
CD1CE1CZCBB179.8°180.0°
CD1CE1CZCE20.2°0.3°
CD1CGCBCD2180.0°179.7°
CD1CGCBCA100.1°89.7°
CGCD1CE1CZ0.2°0.0°
CD1CGCD2CE20.0°0.2°
CD1CGCBH320.1°150.3°
CD1CGCBH4139.7°30.3°
CD1CGCD2H6180.0°179.6°
CGCD1CE1H7179.8°179.9°
OCCACB112.1°120.0°
OCCAN9.4°0.1°
OCCAH2129.6°120.1°
OCNASH36179.4°180.0°
CCACBCG165.9°175.0°
CCACBN122.1°120.0°
CCACBH2118.4°119.9°
CCANH2119.5°119.9°
CCANCAI125.4°155.0°
CCANH154.7°24.8°
CCACBH345.8°65.0°
CCACBH473.9°55.0°
CACNASH360.5°0.0°
CGCBCAH3120.2°120.0°
CGCBCAH4120.2°120.1°
CGCBCAN71.9°65.0°
CBCGCD2CE2180.0°179.9°
CGCBCAH247.5°55.1°
CGCBH3H4119.5°120.0°
CBCGCD1H50.1°0.1°
CBCGCD2H60.0°0.1°
CACBCGCD279.9°90.0°
CBCANH2118.8°120.0°
CBCANCAI113.0°85.0°
CBCANH167.0°95.3°
CACBH3H4119.5°120.0°
CE1CZCBBNBC18.5°180.0°
CE1CZCBBCE2180.0°179.7°
CE1CZCE2CD20.1°0.4°
CE1CZCBBOBD161.5°0.0°
CZCE1CD1H5179.8°179.9°
CE1CZCE2H8179.9°179.7°
CGCD2CE2CZ0.0°0.1°
CGCD2CE2H6180.0°179.9°
CD2CGCBH3159.9°30.0°
CD2CGCBH440.3°150.0°
CD2CGCD1H5179.9°179.8°
CGCD2CE2H8180.0°180.0°
CANCAIH1180.0°179.7°
CANCAIOAQ0.7°0.3°
CANCAICAG178.9°179.8°
NCACBH3167.9°55.0°
NCACBH448.2°175.0°
NBCCBBCZOBD180.0°180.0°
NBCCBBCZCE2161.5°0.3°
CBBNBCH37H38179.9°180.0°
CBBCZCE2CD2179.9°179.9°
CBBCZCE1H70.2°0.1°
CBBCZCE2H80.1°0.0°
CZCBBNBCH37180.0°0.0°
CZCBBNBCH380.0°180.0°
CZCE2CD2H8180.0°179.9°
CE2CZCBBOBD18.5°179.7°
CZCE2CD2H6180.0°180.0°
CE2CZCE1H7179.8°179.8°
OBDCBBNBCH370.0°180.0°
OBDCBBNBCH38180.0°0.0°
NCAIOAQCAG178.0°180.0°
NCAICAGCAE100.5°60.0°
NCAICAGCAH127.5°180.0°
CAINCAH25.8°35.0°
NCAICAGH1411.4°60.0°
OAQCAICAGCAE77.7°120.0°
OAQCAICAGCAH54.4°0.0°
OAQCAINH1179.2°180.0°
OAQCAICAGH14170.5°120.1°
CAICAGCAECAH131.8°120.0°
CAICAGCAEH14111.9°119.9°
CAICAGCAHH14116.2°119.9°
CAICAGCAHCAN23.5°180.0°
CAICAGCAECAF53.0°60.3°
CAICAGCAECAD124.2°120.0°
CAICAGCAHCAJ99.3°60.0°
CAGCAINH11.1°0.0°
CAICAGCAHH15141.2°60.1°
CAECAGCAHH14116.2°120.1°
CAECAGCAHCAN151.0°60.0°
CAGCAECAFCAD177.1°179.7°
CAGCAECAFCAA179.5°179.7°
CAECAGCAHCAJ28.3°180.0°
CAGCAECADCAC179.1°180.0°
CAGCAECADH120.9°0.0°
CAGCAECAFH130.6°0.3°
CAECAGCAHH1591.2°59.9°
CAGCAHCANCAJ127.9°120.0°
CAGCAHCANH15117.5°119.9°
CAGCAHCANCAM164.0°180.0°
CAHCAGCAECAF78.9°59.7°
CAHCAGCAECAD104.0°120.0°
CAGCAHCAJH15119.4°120.1°
CAGCAHCAJCAK166.2°180.0°
CAGCAHCAJH1646.2°60.0°
CAGCAHCAJH1773.9°59.9°
CAGCAHCANH2476.2°60.0°
CAGCAHCANH2544.1°60.0°
CAHCANCAMH24119.8°120.0°
CAHCANCAMH25119.8°120.0°
CANCAHCAJH15114.7°120.0°
CAHCANCAMCAL53.3°60.0°
CANCAHCAJCAK67.9°60.0°
CANCAHCAGH1492.7°60.1°
CANCAHCAJH16172.1°180.0°
CANCAHCAJH1752.1°60.0°
CAHCANCAMH22173.9°60.0°
CAHCANCAMH2367.3°180.0°
CAHCANH24H25120.5°120.0°
CAMCANCAHCAJ68.1°60.0°
CANCAMCALH22120.7°120.0°
CANCAMCALH23120.6°120.0°
CANCAMCALCAK37.7°60.0°
CAMCANCAHH1546.5°60.1°
CANCAMCALH2083.1°179.9°
CANCAMCALH21158.6°60.0°
CANCAMH22H23118.0°120.0°
CAMCANH24H25120.5°120.0°
CAECAFCAAH13180.0°179.4°
CAECAFCAACAB1.7°0.6°
CAFCAECADCAC1.9°0.3°
CAECAFCAAH9178.3°179.7°
CAFCAECADH12178.1°179.8°
CAFCAECAGH14164.9°179.8°
CAACAFCAECAD2.4°0.6°
CAFCAACABH9180.0°179.7°
CAFCAACABCAC0.6°0.3°
CAFCAACABH10179.4°179.8°
CAECADCACH12180.0°180.0°
CAECADCACCAB0.8°0.0°
CAECADCACH11179.2°180.0°
CADCAECAFH13177.7°180.0°
CADCAECAGH1412.2°0.1°
CAHCAJCAKH16119.9°120.0°
CAHCAJCAKH17120.0°120.1°
CAHCAJCAKCAL52.2°60.1°
CAJCAHCAGH14144.5°59.9°
CAHCAJH16H17120.1°120.0°
CAHCAJCAKH1868.4°59.9°
CAHCAJCAKH19172.9°180.0°
CAJCAHCANH2451.7°60.0°
CAJCAHCANH25172.1°180.0°
CAACABCACCAD0.1°0.0°
CAACABCACH10180.0°179.9°
CAACABCACH11179.9°179.9°
CABCAACAFH13178.3°180.0°
CAMCALCAKCAJ37.0°60.0°
CAMCALCAKH20120.9°119.9°
CAMCALCAKH21120.8°120.0°
CAMCALCAKH1883.6°59.9°
CAMCALCAKH19157.7°180.0°
CAMCALH20H21117.3°120.0°
CALCAMH22H23118.0°120.0°
CALCAMCANH2466.5°60.0°
CALCAMCANH25173.1°180.0°
CADCACCABH11180.0°179.9°
CADCACCABH10179.8°179.9°
CACCABCAAH9179.4°180.0°
CABCACCADH12179.2°180.0°
CAJCAKCALH18120.7°120.0°
CAJCAKCALH19120.7°120.0°
CAKCAJCAHH1546.8°59.9°
CAKCAJH16H17120.1°120.0°
CAJCAKH18H19118.0°120.0°
CAJCAKCALH2083.8°180.0°
CAJCAKCALH21157.9°60.0°
CALCAKCAJH16172.2°179.9°
CALCAKCAJH1767.7°60.0°
CALCAKH18H19117.9°120.0°
CAKCALH20H21117.4°120.1°
CAKCALCAMH22158.4°60.0°
CAKCALCAMH2382.9°179.9°
H1NCAH2174.2°144.7°
H2CACBH372.6°175.1°
H2CACBH4167.7°65.0°
H5CD1CE1H70.2°0.0°
H6CD2CE2H80.0°0.1°
H9CAACABH100.6°0.1°
H9CAACAFH131.7°0.3°
H10CABCACH110.1°0.0°
H11CACCADH120.8°0.0°
H14CAGCAHH1525.0°180.0°
H15CAHCAJH1673.1°60.1°
H15CAHCAJH17166.8°180.0°
H15CAHCANH24166.3°180.0°
H15CAHCANH2573.3°60.0°
H16CAJCAKH1851.5°60.1°
H16CAJCAKH1967.2°60.0°
H17CAJCAKH18171.6°180.0°
H17CAJCAKH1952.9°60.0°
H18CAKCALH20155.5°60.0°
H18CAKCALH2137.2°179.9°
H19CAKCALH2036.8°60.1°
H19CAKCALH2181.5°60.0°
H20CALCAMH2237.5°59.9°
H20CALCAMH23156.2°60.0°
H21CALCAMH2280.7°180.0°
H21CALCAMH2338.0°60.0°
H22CAMCANH2454.1°180.0°
H22CAMCANH2566.3°60.0°
H23CAMCANH24172.9°60.0°
H23CAMCANH2552.5°59.9°
H26CBECBJH3048.9°175.0°
H26CBECBJH31167.4°65.0°
H26CBENASH36141.7°145.0°
H27CBHH28H29120.0°119.9°
H27CBHNBGH390.0°0.0°
H28CBHNBGH39120.0°120.0°
H29CBHNBGH39120.0°120.0°
H32CBLCBMH330.3°0.0°
H33CBMCBNH340.2°0.0°

221051

PDB entries from 2024-06-12

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