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SD2

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
CBESBDsing1.81Å1.79Å
CBEHBE1sing1.09Å1.11Å
CBEHBE2sing1.09Å1.12Å
CBEHBE3sing1.09Å1.12Å
SBDCBCsing1.81Å1.81Å
CBCCBBsing1.53Å1.37Å
CBCHBC1sing1.09Å1.11Å
CBCHBC2sing1.09Å1.11Å
CBBCAYsing1.53Å1.52Å
CBBHBB1sing1.09Å1.11Å
CBBHBB2sing1.09Å1.11Å
CAYCAZsing1.51Å1.53Å
CAYNAXsing1.47Å1.42Å
CAYHAYsing1.09Å1.12Å
CAZOBAdoub1.21Å1.24Å
CAZNBFsing1.35Å1.33Å
NBFHBF1sing0.97Å1.02Å
NBFHBF2sing0.97Å1.02Å
NAXCASsing1.35Å1.31Å
NAXHAXsing0.97Å1.02Å
CASOATdoub1.21Å1.23Å
CASCARsing1.51Å1.51Å
CARCAUsing1.55Å1.54Å
CARNAQsing1.48Å1.45Å
CARHARsing1.09Å1.11Å
CAUCAVsing1.55Å1.52Å
CAUHAU1sing1.09Å1.12Å
CAUHAU2sing1.09Å1.11Å
CAVCAWsing1.54Å1.52Å
CAVHAV1sing1.09Å1.11Å
CAVHAV2sing1.09Å1.12Å
CAWNAQsing1.47Å1.46Å
CAWHAW1sing1.09Å1.11Å
CAWHAW2sing1.09Å1.11Å
NAQCAGsing1.35Å1.33Å
CAGOAHdoub1.21Å1.23Å
CAGCAFsing1.51Å1.53Å
CAFNAAsing1.47Å1.48Å
CAFCAIsing1.53Å1.55Å
CAFHAFsing1.09Å1.12Å
NAACABsing1.35Å1.33Å
NAAHAAsing0.97Å1.02Å
CABOACdoub1.21Å1.23Å
CABCADsing1.51Å1.52Å
CADSAEsing1.81Å1.83Å
CADHAD1sing1.09Å1.11Å
CADHAD2sing1.09Å1.12Å
SAEHAEsing1.34Å0.95Å
CAICAJsing1.51Å1.53Å
CAIHAI1sing1.09Å1.12Å
CAIHAI2sing1.09Å1.12Å
CAJCAKdoub1.38Å1.40ÅAromatic
CAJCALsing1.38Å1.40ÅAromatic
CAKCAMsing1.38Å1.40ÅAromatic
CAKHAKsing1.08Å1.10Å
CAMCAOdoub1.39Å1.40ÅAromatic
CAMHAMsing1.08Å1.10Å
CAOOAPsing1.36Å1.36Å
CAOCANsing1.39Å1.40ÅAromatic
OAPHAPsing0.97Å0.95Å
CANCALdoub1.38Å1.40ÅAromatic
CANHANsing1.08Å1.10Å
CALHALsing1.08Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
SBDCBEHBE1113.7°109.5°
SBDCBEHBE2105.6°109.5°
SBDCBEHBE3113.7°109.5°
CBESBDCBC105.6°100.0°
HBE1CBEHBE2113.7°109.5°
HBE1CBEHBE396.8°109.4°
HBE2CBEHBE3113.6°109.4°
SBDCBCCBB118.7°109.5°
SBDCBCHBC1108.9°109.5°
SBDCBCHBC2108.9°109.5°
CBBCBCHBC1108.9°109.4°
CBBCBCHBC2108.9°109.5°
CBCCBBCAY119.9°109.5°
CBCCBBHBB1108.5°109.4°
CBCCBBHBB2108.5°109.5°
HBC1CBCHBC2101.2°109.5°
CAYCBBHBB1108.4°109.5°
CAYCBBHBB2108.5°109.5°
CBBCAYCAZ107.3°109.5°
CBBCAYNAX99.0°109.5°
CBBCAYHAY116.0°109.5°
HBB1CBBHBB2101.5°109.5°
CAZCAYNAX105.7°109.5°
CAZCAYHAY110.3°109.5°
CAYCAZOBA120.5°120.0°
CAYCAZNBF115.5°120.0°
NAXCAYHAY117.4°109.4°
CAYNAXCAS137.8°120.0°
CAYNAXHAX117.2°120.0°
OBACAZNBF123.9°120.0°
CAZNBFHBF1115.5°120.0°
CAZNBFHBF2123.9°120.0°
HBF1NBFHBF2120.6°120.0°
CASNAXHAX104.9°120.0°
NAXCASOAT130.2°120.0°
NAXCASCAR106.3°120.0°
OATCASCAR123.5°120.0°
CASCARCAU106.9°110.4°
CASCARNAQ113.7°110.4°
CASCARHAR106.9°110.3°
CAUCARNAQ104.2°104.9°
CAUCARHAR116.0°110.4°
CARCAUCAV105.1°101.6°
CARCAUHAU1113.9°111.0°
CARCAUHAU2113.9°111.0°
NAQCARHAR109.5°110.4°
CARNAQCAW113.5°108.6°
CARNAQCAG121.7°125.7°
CAVCAUHAU1113.9°111.0°
CAVCAUHAU2113.9°111.0°
CAUCAVCAW104.7°102.9°
CAUCAVHAV1114.0°110.7°
CAUCAVHAV2114.0°110.7°
HAU1CAUHAU296.6°110.9°
CAWCAVHAV1114.0°110.8°
CAWCAVHAV2114.0°110.7°
CAVCAWNAQ102.1°107.3°
CAVCAWHAW1115.0°109.9°
CAVCAWHAW2115.0°109.9°
HAV1CAVHAV296.5°110.8°
NAQCAWHAW1115.0°109.9°
NAQCAWHAW2115.0°109.8°
CAWNAQCAG124.0°125.7°
HAW1CAWHAW295.4°110.0°
NAQCAGOAH119.1°120.0°
NAQCAGCAF120.7°120.0°
OAHCAGCAF120.1°120.0°
CAGCAFNAA110.0°109.5°
CAGCAFCAI109.8°109.5°
CAGCAFHAF109.2°109.5°
NAACAFCAI110.2°109.5°
NAACAFHAF108.7°109.5°
CAFNAACAB121.7°120.0°
CAFNAAHAA124.3°119.9°
CAICAFHAF108.9°109.5°
CAFCAICAJ111.8°109.5°
CAFCAIHAI1111.4°109.5°
CAFCAIHAI2111.3°109.5°
CABNAAHAA114.0°120.0°
NAACABOAC124.1°120.0°
NAACABCAD115.3°120.0°
OACCABCAD120.6°120.1°
CABCADSAE109.9°109.4°
CABCADHAD1112.0°109.5°
CABCADHAD2112.1°109.5°
SAECADHAD1112.1°109.5°
SAECADHAD2112.0°109.5°
CADSAEHAE109.9°100.0°
HAD1CADHAD298.3°109.5°
CAJCAIHAI1111.3°109.4°
CAJCAIHAI2111.4°109.4°
CAICAJCAK119.4°119.9°
CAICAJCAL120.7°120.0°
HAI1CAIHAI299.0°109.5°
CAKCAJCAL119.9°120.1°
CAJCAKCAM120.1°120.0°
CAJCAKHAK119.9°120.0°
CAJCALCAN120.1°120.1°
CAJCALHAL119.8°119.9°
CAMCAKHAK120.0°120.0°
CAKCAMCAO120.0°119.9°
CAKCAMHAM119.9°120.0°
CAOCAMHAM120.1°120.0°
CAMCAOOAP119.8°120.1°
CAMCAOCAN119.9°119.9°
OAPCAOCAN120.2°120.1°
CAOOAPHAP119.8°106.7°
CAOCANCAL120.0°120.0°
CAOCANHAN119.9°120.0°
CALCANHAN120.1°120.0°
CANCALHAL120.0°120.0°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
SBDCBEHBE1HBE2120.8°120.0°
SBDCBEHBE1HBE3119.6°120.1°
SBDCBEHBE2HBE3125.3°120.1°
CBESBDCBCCBB79.2°180.0°
CBESBDCBCHBC1155.6°60.0°
CBESBDCBCHBC246.1°60.0°
HBE1CBEHBE2HBE3109.5°119.9°
HBE1CBESBDCBC54.8°60.0°
HBE2CBESBDCBC180.0°180.0°
HBE3CBESBDCBC54.7°60.0°
SBDCBCCBBHBC1125.3°120.0°
SBDCBCCBBHBC2125.2°120.0°
SBDCBCHBC1HBC2114.6°120.0°
SBDCBCCBBCAY178.5°180.0°
SBDCBCCBBHBB153.2°60.0°
SBDCBCCBBHBB256.3°60.0°
CBBCBCHBC1HBC2114.6°120.0°
CBCCBBCAYHBB1125.3°120.0°
CBCCBBCAYHBB2125.2°120.0°
CBCCBBHBB1HBB2114.1°120.0°
CBCCBBCAYCAZ164.4°175.0°
CBCCBBCAYNAX86.0°65.0°
CBCCBBCAYHAY40.6°55.0°
HBC1CBCCBBCAY56.3°60.0°
HBC1CBCCBBHBB1178.5°180.0°
HBC1CBCCBBHBB269.0°60.0°
HBC2CBCCBBCAY53.2°60.0°
HBC2CBCCBBHBB172.0°60.0°
HBC2CBCCBBHBB2178.5°180.0°
CAYCBBHBB1HBB2114.1°120.0°
CBBCAYCAZNAX104.9°120.0°
CBBCAYCAZHAY127.2°120.0°
CBBCAYNAXHAY125.6°120.0°
CBBCAYCAZOBA71.2°120.0°
CBBCAYCAZNBF108.8°60.0°
CBBCAYNAXCAS134.4°155.0°
CBBCAYNAXHAX45.6°25.0°
HBB1CBBCAYCAZ70.4°55.0°
HBB1CBBCAYNAX39.3°175.0°
HBB1CBBCAYHAY165.8°65.0°
HBB2CBBCAYCAZ39.1°65.0°
HBB2CBBCAYNAX148.8°55.0°
HBB2CBBCAYHAY84.7°175.0°
CAZCAYNAXHAY123.5°120.0°
CAYCAZOBANBF180.0°180.0°
CAYCAZNBFHBF1180.0°0.1°
CAYCAZNBFHBF20.0°180.0°
CAZCAYNAXCAS114.7°85.0°
CAZCAYNAXHAX65.3°95.0°
NAXCAYCAZOBA33.7°0.0°
NAXCAYCAZNBF146.3°180.0°
CAYNAXCASHAX180.0°180.0°
CAYNAXCASOAT4.2°0.0°
CAYNAXCASCAR179.7°180.0°
HAYCAYCAZOBA161.6°120.0°
HAYCAYCAZNBF18.4°60.0°
HAYCAYNAXCAS8.8°35.0°
HAYCAYNAXHAX171.2°145.0°
OBACAZNBFHBF10.0°180.0°
OBACAZNBFHBF2180.0°0.1°
CAZNBFHBF1HBF2180.0°179.9°
NAXCASOATCAR175.6°180.0°
NAXCASCARCAU63.9°90.3°
NAXCASCARNAQ178.2°154.2°
NAXCASCARHAR60.9°31.9°
HAXNAXCASOAT175.8°180.0°
HAXNAXCASCAR0.3°0.0°
OATCASCARCAU112.6°89.7°
OATCASCARNAQ1.7°25.8°
OATCASCARHAR122.6°148.0°
CASCARCAUNAQ120.6°118.9°
CASCARCAUHAR119.0°122.2°
CASCARNAQHAR119.4°122.2°
CASCARCAUCAV137.6°155.8°
CASCARCAUHAU197.1°37.7°
CASCARCAUHAU212.4°86.1°
CASCARNAQCAW112.7°142.9°
CASCARNAQCAG76.9°37.0°
CAUCARNAQHAR124.7°118.9°
CARCAUCAVHAU1125.3°118.1°
CARCAUCAVHAU2125.3°118.0°
CARCAUHAU1HAU2119.8°123.8°
CARCAUCAVCAW30.3°35.5°
CARCAUCAVHAV195.0°153.9°
CARCAUCAVHAV2155.6°82.8°
CAUCARNAQCAW3.3°24.0°
CAUCARNAQCAG167.2°155.9°
NAQCARCAUCAV17.0°37.0°
NAQCARCAUHAU1142.2°81.1°
NAQCARCAUHAU2108.3°155.1°
CARNAQCAWCAV21.8°0.9°
CARNAQCAWCAG170.2°179.9°
CARNAQCAWHAW1147.1°120.4°
CARNAQCAWHAW2103.4°118.5°
CARNAQCAGOAH0.7°5.8°
CARNAQCAGCAF179.9°174.2°
HARCARCAUCAV103.4°82.0°
HARCARCAUHAU121.9°160.0°
HARCARCAUHAU2131.4°36.2°
HARCARNAQCAW127.9°94.9°
HARCARNAQCAG42.5°85.2°
CAVCAUHAU1HAU2119.8°124.0°
CAUCAVCAWHAV1125.3°118.4°
CAUCAVCAWHAV2125.3°118.3°
CAUCAVHAV1HAV2119.9°123.2°
CAUCAVCAWNAQ31.3°22.3°
CAUCAVCAWHAW1156.6°97.3°
CAUCAVCAWHAW294.0°141.6°
HAU1CAUCAVCAW155.6°82.6°
HAU1CAUCAVHAV130.3°35.8°
HAU1CAUCAVHAV279.2°159.1°
HAU2CAUCAVCAW95.0°153.5°
HAU2CAUCAVHAV1139.8°88.1°
HAU2CAUCAVHAV230.3°35.2°
CAWCAVHAV1HAV2119.9°123.3°
CAVCAWNAQHAW1125.3°119.5°
CAVCAWNAQHAW2125.3°119.4°
CAVCAWHAW1HAW2120.9°121.1°
CAVCAWNAQCAG148.3°179.0°
HAV1CAVCAWNAQ94.0°140.6°
HAV1CAVCAWHAW131.3°21.1°
HAV1CAVCAWHAW2140.7°100.0°
HAV2CAVCAWNAQ156.5°96.0°
HAV2CAVCAWHAW178.2°144.4°
HAV2CAVCAWHAW231.3°23.3°
NAQCAWHAW1HAW2120.9°121.0°
CAWNAQCAGOAH170.1°174.3°
CAWNAQCAGCAF10.7°5.7°
HAW1CAWNAQCAG23.1°59.5°
HAW2CAWNAQCAG86.4°61.6°
NAQCAGOAHCAF179.2°180.0°
NAQCAGCAFNAA127.9°160.0°
NAQCAGCAFCAI110.6°80.0°
NAQCAGCAFHAF8.7°40.0°
OAHCAGCAFNAA52.9°20.0°
OAHCAGCAFCAI68.6°100.0°
OAHCAGCAFHAF172.1°140.0°
CAGCAFNAACAI121.2°120.0°
CAGCAFNAAHAF119.5°120.0°
CAGCAFCAIHAF119.5°120.0°
CAGCAFNAACAB156.8°60.0°
CAGCAFNAAHAA23.2°120.0°
CAGCAFCAICAJ77.6°175.0°
CAGCAFCAIHAI147.7°65.1°
CAGCAFCAIHAI2157.2°55.0°
NAACAFCAIHAF119.2°120.0°
CAFNAACABHAA180.0°180.0°
CAFNAACABOAC0.2°0.0°
CAFNAACABCAD179.6°180.0°
NAACAFCAICAJ161.1°65.0°
NAACAFCAIHAI173.6°54.9°
NAACAFCAIHAI235.9°175.0°
CAICAFNAACAB82.0°60.0°
CAICAFNAAHAA98.0°120.0°
CAFCAICAJHAI1125.3°120.0°
CAFCAICAJHAI2125.2°120.0°
CAFCAIHAI1HAI2117.2°120.1°
CAFCAICAJCAK99.7°89.9°
CAFCAICAJCAL76.6°90.2°
HAFCAFNAACAB37.3°180.0°
HAFCAFNAAHAA142.7°0.0°
HAFCAFCAICAJ42.0°55.0°
HAFCAFCAIHAI1167.2°175.0°
HAFCAFCAIHAI283.3°65.0°
NAACABOACCAD179.3°180.0°
NAACABCADSAE137.2°180.0°
NAACABCADHAD111.9°60.0°
NAACABCADHAD297.6°60.0°
HAANAACABOAC179.8°180.0°
HAANAACABCAD0.5°0.0°
OACCABCADSAE42.2°0.0°
OACCABCADHAD1167.5°120.0°
OACCABCADHAD283.1°120.0°
CABCADSAEHAD1125.3°120.0°
CABCADSAEHAD2125.3°120.0°
CABCADHAD1HAD2118.0°120.0°
CABCADSAEHAE180.0°180.0°
SAECADHAD1HAD2117.9°120.0°
HAD1CADSAEHAE54.7°60.0°
HAD2CADSAEHAE54.7°60.0°
CAJCAIHAI1HAI2117.2°119.9°
CAICAJCAKCAL176.3°179.8°
CAICAJCAKCAM175.6°179.9°
CAICAJCAKHAK4.4°0.0°
CAICAJCALCAN175.5°179.7°
CAICAJCALHAL4.5°0.1°
HAI1CAICAJCAK135.0°30.0°
HAI1CAICAJCAL48.7°149.8°
HAI2CAICAJCAK25.5°150.0°
HAI2CAICAJCAL158.2°29.8°
CAJCAKCAMHAK180.0°179.9°
CAJCAKCAMCAO0.0°0.1°
CAJCAKCAMHAM180.0°180.0°
CAKCAJCALCAN0.7°0.5°
CAKCAJCALHAL179.3°179.9°
CALCAJCAKCAM0.7°0.3°
CALCAJCAKHAK179.3°179.8°
CAJCALCANCAO0.1°0.5°
CAJCALCANHAL180.0°179.6°
CAJCALCANHAN179.9°179.8°
CAKCAMCAOHAM180.0°179.9°
CAKCAMCAOOAP176.8°180.0°
CAKCAMCAOCAN0.7°0.1°
HAKCAKCAMCAO180.0°180.0°
HAKCAKCAMHAM0.0°0.1°
CAMCAOOAPCAN177.5°179.9°
CAMCAOOAPHAP180.0°90.0°
CAMCAOCANCAL0.6°0.3°
CAMCAOCANHAN179.4°180.0°
HAMCAMCAOOAP3.2°0.1°
HAMCAMCAOCAN179.4°180.0°
OAPCAOCANCAL176.9°179.8°
OAPCAOCANHAN3.1°0.1°
CANCAOOAPHAP2.5°90.1°
CAOCANCALHAN180.0°179.7°
CAOCANCALHAL179.9°179.9°
HANCANCALHAL0.1°0.2°

222415

PDB entries from 2024-07-10

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