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74D

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
CAVCAUdoub1.39Å1.41ÅAromatic
CAVCAWsing1.38Å1.41ÅAromatic
CAUCATsing1.38Å1.40ÅAromatic
FBICBHsing1.40Å1.27Å
CAWCASdoub1.39Å1.39ÅAromatic
CBECBFsing1.53Å1.55Å
CBENBDsing1.47Å1.46Å
CBGCBHsing1.53Å1.52Å
CBGNBDsing1.47Å1.50Å
CBFCBAsing1.53Å1.54Å
CATCARdoub1.39Å1.38ÅAromatic
CBHFBJsing1.40Å1.37Å
CBHCBKsing1.53Å1.56Å
NBDCBCsing1.47Å1.47Å
CASCARsing1.40Å1.44ÅAromatic
CASCANsing1.47Å1.39ÅAromatic
OAHCADdoub1.22Å1.24Å
CARNAQsing1.38Å1.45ÅAromatic
OAOCAMdoub1.22Å1.24Å
CAKNALsing1.47Å1.47Å
CAKCACsing1.53Å1.42Å
CAMCANsing1.47Å1.36Å
CAMNALsing1.35Å1.35Å
CANCAPdoub1.36Å1.36ÅAromatic
CBACAYsing1.53Å1.55Å
CBACBBsing1.53Å1.55Å
NAQCAPsing1.35Å1.35ÅAromatic
NAQCAYsing1.47Å1.47Å
CADCACsing1.52Å1.41Å
CADNAEsing1.33Å1.41Å
CAPCAXsing1.51Å1.54Å
CBCCBBsing1.53Å1.49Å
CACCABsing1.52Å1.39Å
CAYCAZsing1.53Å1.53Å
NAECAFdoub1.31Å1.40Å
CABOAIsing1.35Å1.36Å
CABCAAdoub1.36Å1.39Å
OAICAJsing1.45Å1.43Å
CAFCAAsing1.39Å1.38Å
CAFCAGsing1.51Å1.38Å
CBKH1sing1.09Å1.10Å
CBKH2sing1.09Å1.10Å
CBKH3sing1.09Å1.10Å
CBGH4sing1.09Å1.10Å
CBGH5sing1.09Å1.10Å
CBEH7sing1.09Å1.10Å
CBEH8sing1.09Å1.10Å
CBFH9sing1.09Å1.10Å
CBFH10sing1.09Å1.10Å
CBCH11sing1.09Å1.10Å
CBCH12sing1.09Å1.10Å
CBBH13sing1.09Å1.10Å
CBBH14sing1.09Å1.10Å
CBAH15sing1.09Å1.10Å
CAYH16sing1.09Å1.10Å
CAZH17sing1.09Å1.10Å
CAZH18sing1.09Å1.10Å
CAZH19sing1.09Å1.10Å
CAXH20sing1.09Å1.10Å
CAXH21sing1.09Å1.10Å
CAXH22sing1.09Å1.10Å
CATH23sing1.08Å1.08Å
CAUH24sing1.08Å1.08Å
CAVH25sing1.08Å1.08Å
CAWH26sing1.08Å1.08Å
NALH27sing0.97Å1.00Å
CAKH28sing1.09Å1.10Å
CAKH29sing1.09Å1.10Å
CACH30sing1.09Å1.10Å
CAGH31sing1.09Å1.10Å
CAGH32sing1.09Å1.10Å
CAGH33sing1.09Å1.10Å
CAAH34sing1.08Å1.08Å
CAJH35sing1.09Å1.10Å
CAJH36sing1.09Å1.10Å
CAJH37sing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
CAUCAVCAW122.5°120.3°
CAVCAUCAT120.2°120.6°
CAVCAUH24119.9°119.7°
CAUCAVH25118.7°119.8°
CAVCAWCAS117.7°119.7°
CAWCAVH25118.8°119.8°
CAVCAWH26121.2°120.1°
CAUCATCAR117.5°119.9°
CAUCATH23121.2°120.1°
CATCAUH24119.9°119.6°
FBICBHCBG106.6°109.5°
FBICBHFBJ108.7°109.5°
FBICBHCBK107.7°109.4°
CAWCASCAR119.0°120.1°
CAWCASCAN131.0°134.1°
CASCAWH26121.2°120.2°
CBFCBENBD110.4°109.5°
CBECBFCBA107.3°109.3°
CBFCBEH7109.2°109.5°
CBFCBEH8109.3°109.5°
CBECBFH9110.0°109.5°
CBECBFH10110.0°109.5°
CBENBDCBG114.0°111.0°
CBENBDCBC113.6°111.2°
NBDCBEH7109.3°109.5°
NBDCBEH8109.2°109.5°
CBHCBGNBD115.3°109.5°
CBGCBHFBJ110.7°109.5°
CBGCBHCBK112.2°109.4°
CBHCBGH4108.0°109.4°
CBHCBGH5108.0°109.5°
CBGNBDCBC114.8°111.0°
NBDCBGH4108.0°109.4°
NBDCBGH5108.0°109.5°
CBFCBACAY117.6°109.5°
CBFCBACBB108.6°109.1°
CBACBFH9110.0°109.5°
CBACBFH10110.0°109.5°
CBFCBAH15107.0°109.5°
CATCARCAS122.9°119.4°
CATCARNAQ132.8°133.2°
CARCATH23121.2°120.0°
FBJCBHCBK110.7°109.5°
CBHCBKH1109.5°109.5°
CBHCBKH2109.5°109.5°
CBHCBKH3109.5°109.4°
NBDCBCCBB110.5°109.5°
NBDCBCH11109.2°109.5°
NBDCBCH12109.2°109.5°
CARCASCAN109.8°105.9°
CASCARNAQ104.2°107.4°
CASCANCAM125.0°126.8°
CASCANCAP105.6°106.5°
OAHCADCAC122.8°120.8°
OAHCADNAE117.1°120.9°
CARNAQCAP106.6°110.5°
CARNAQCAY128.8°124.7°
OAOCAMCAN122.6°120.0°
OAOCAMNAL122.3°120.0°
NALCAKCAC101.6°109.5°
CAKNALCAM124.0°120.0°
CAKNALH27118.0°120.0°
NALCAKH28111.4°109.5°
NALCAKH29111.4°109.4°
CAKCACCAD123.1°108.0°
CAKCACCAB118.2°108.0°
CACCAKH28111.4°109.5°
CACCAKH29111.4°109.5°
CAKCACH3091.2°107.9°
CANCAMNAL114.9°120.0°
CAMCANCAP129.4°126.8°
CAMNALH27118.0°120.1°
CANCAPNAQ113.8°109.8°
CANCAPCAX122.2°125.1°
CAYCBACBB109.4°109.5°
CBACAYNAQ114.6°109.5°
CBACAYCAZ113.5°109.5°
CAYCBAH15106.9°109.5°
CBACAYH16104.6°109.5°
CBACBBCBC103.9°109.3°
CBACBBH13110.9°109.5°
CBACBBH14110.9°109.6°
CBBCBAH15106.8°109.6°
CAPNAQCAY124.7°124.8°
NAQCAPCAX124.1°125.1°
NAQCAYCAZ112.7°109.5°
NAQCAYH16105.4°109.5°
CACCADNAE120.1°118.3°
CADCACCAB118.6°116.5°
CADCACH3091.1°108.0°
CADNAECAF119.7°122.8°
CAPCAXH20109.5°109.5°
CAPCAXH21109.5°109.5°
CAPCAXH22109.5°109.4°
CBBCBCH11109.2°109.5°
CBBCBCH12109.2°109.5°
CBCCBBH13110.9°109.5°
CBCCBBH14110.9°109.5°
CACCABOAI114.0°121.4°
CACCABCAA121.2°117.2°
CABCACH3091.2°108.1°
CAZCAYH16104.8°109.4°
CAYCAZH17109.5°109.5°
CAYCAZH18109.5°109.4°
CAYCAZH19109.5°109.5°
NAECAFCAA120.3°124.3°
NAECAFCAG120.1°117.9°
OAICABCAA124.7°121.4°
CABOAICAJ119.6°117.1°
CABCAACAF120.0°120.9°
CABCAAH34120.0°119.6°
OAICAJH35109.5°109.4°
OAICAJH36109.5°109.4°
OAICAJH37109.5°109.5°
CAACAFCAG119.6°117.8°
CAFCAAH34120.0°119.5°
CAFCAGH31109.5°109.5°
CAFCAGH32109.5°109.5°
CAFCAGH33109.5°109.5°
H1CBKH2109.5°109.5°
H1CBKH3109.4°109.5°
H2CBKH3109.5°109.5°
H4CBGH5109.5°109.6°
H7CBEH8109.4°109.4°
H9CBFH10109.5°109.6°
H11CBCH12109.4°109.4°
H13CBBH14109.4°109.5°
H17CAZH18109.5°109.5°
H17CAZH19109.4°109.5°
H18CAZH19109.5°109.5°
H20CAXH21109.4°109.5°
H20CAXH22109.5°109.5°
H21CAXH22109.5°109.5°
H28CAKH29109.5°109.5°
H31CAGH32109.5°109.5°
H31CAGH33109.5°109.4°
H32CAGH33109.4°109.5°
H35CAJH36109.5°109.4°
H35CAJH37109.5°109.5°
H36CAJH37109.4°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
CAUCAVCAWH25180.0°179.9°
CAVCAUCATH24180.0°179.9°
CAUCAVCAWCAS1.1°0.0°
CAVCAUCATCAR1.3°0.1°
CAVCAUCATH23178.7°180.0°
CAUCAVCAWH26178.9°179.9°
CAWCAVCAUCAT0.5°0.1°
CAVCAWCASH26180.0°179.9°
CAVCAWCASCAR2.5°0.1°
CAVCAWCASCAN178.8°179.7°
CAWCAVCAUH24179.5°179.9°
CAUCATCARH23180.0°180.0°
CAUCATCARCAS2.8°0.0°
CAUCATCARNAQ178.9°180.0°
CATCAUCAVH25179.5°180.0°
FBICBHCBGFBJ118.0°120.0°
FBICBHCBGCBK117.7°119.9°
FBICBHCBGNBD147.3°54.4°
FBICBHFBJCBK118.1°120.0°
FBICBHCBKH1180.0°60.1°
FBICBHCBKH260.0°60.0°
FBICBHCBKH360.0°180.0°
FBICBHCBGH426.4°174.3°
FBICBHCBGH591.8°65.7°
CAWCASCARCAT3.4°0.1°
CAWCASCARCAN177.1°179.8°
CAWCASCARNAQ179.5°180.0°
CAWCASCANCAM2.6°0.0°
CAWCASCANCAP178.6°179.8°
CASCAWCAVH25178.9°179.9°
CBFCBENBDH7120.1°120.1°
CBFCBENBDH8120.2°120.0°
CBFCBENBDCBG161.6°62.4°
CBECBFCBAH9119.7°119.9°
CBECBFCBAH10119.7°119.9°
CBFCBENBDCBC64.4°61.8°
CBECBFCBACAY155.0°177.5°
CBECBFCBACBB30.1°57.7°
CBFCBEH7H8119.6°119.9°
CBECBFH9H10121.0°120.1°
CBECBFCBAH1584.9°62.3°
CBENBDCBGCBH86.0°159.2°
CBENBDCBGCBC133.4°124.3°
NBDCBECBFCBA35.6°59.2°
CBENBDCBCCBB17.0°61.7°
CBENBDCBGH434.8°80.8°
CBENBDCBGH5153.1°39.2°
NBDCBEH7H8119.6°120.0°
NBDCBECBFH9155.3°60.8°
NBDCBECBFH1084.0°179.1°
CBENBDCBCH11137.2°58.3°
CBENBDCBCH12103.2°178.2°
CBHCBGNBDH4120.9°119.9°
CBHCBGNBDH5120.8°120.0°
CBGCBHFBJCBK125.1°120.0°
CBHCBGNBDCBC47.4°76.5°
CBGCBHCBKH163.0°180.0°
CBGCBHCBKH257.0°59.9°
CBGCBHCBKH3177.0°60.0°
CBHCBGH4H5117.3°120.0°
NBDCBGCBHFBJ29.3°65.7°
NBDCBGCBHCBK95.0°174.3°
CBGNBDCBCCBB150.6°62.4°
NBDCBGH4H5117.4°120.0°
CBGNBDCBEH741.5°57.7°
CBGNBDCBEH878.2°177.6°
CBGNBDCBCH1189.2°177.6°
CBGNBDCBCH1230.5°57.6°
CBFCBACAYCBB124.4°119.6°
CBFCBACAYH15120.3°120.1°
CBFCBACBBH15115.1°120.0°
CBFCBACAYNAQ56.6°180.0°
CBFCBACBBCBC76.0°57.7°
CBFCBACAYCAZ74.9°60.0°
CBACBFCBEH7155.8°179.3°
CBACBFCBEH884.5°60.9°
CBACBFH9H10121.0°120.2°
CBFCBACBBH1343.1°177.6°
CBFCBACBBH14164.9°62.3°
CBFCBACAYH16171.5°59.9°
CATCARCASNAQ177.0°180.0°
CATCARCASCAN179.5°179.8°
CATCARNAQCAP178.5°180.0°
CATCARNAQCAY2.7°0.3°
CARCATCAUH24178.7°179.9°
FBJCBHCBKH161.3°60.0°
FBJCBHCBKH2178.7°180.0°
FBJCBHCBKH358.7°60.0°
FBJCBHCBGH491.6°54.2°
FBJCBHCBGH5150.1°174.3°
CBHCBKH1H2120.0°120.1°
CBHCBKH1H3120.0°119.9°
CBHCBKH2H3120.0°119.9°
CBKCBHCBGH4144.1°65.8°
CBKCBHCBGH525.8°54.3°
NBDCBCCBBCBA49.3°59.2°
NBDCBCCBBH11120.2°120.0°
NBDCBCCBBH12120.2°120.0°
CBCNBDCBGH4168.3°43.4°
CBCNBDCBGH573.4°163.5°
CBCNBDCBEH7175.5°178.2°
CBCNBDCBEH855.8°58.3°
NBDCBCH11H12119.5°120.0°
NBDCBCCBBH1369.9°179.2°
NBDCBCCBBH14168.4°60.8°
CARCASCANCAM179.2°179.8°
CARCASCANCAP2.0°0.4°
CASCARNAQCAP1.9°0.1°
CASCARNAQCAY179.3°179.7°
CASCARCATH23177.2°180.0°
CARCASCAWH26177.5°180.0°
CANCASCARNAQ2.4°0.2°
CASCANCAMOAO131.9°89.9°
CASCANCAMCAP178.5°179.8°
CASCANCAMNAL52.8°90.0°
CASCANCAPNAQ0.8°0.4°
CASCANCAPCAX179.2°179.6°
CANCASCAWH261.2°0.2°
OAHCADCACCAK3.4°58.2°
OAHCADCACNAE178.5°180.0°
OAHCADCACCAB179.4°180.0°
OAHCADNAECAF179.8°180.0°
OAHCADCACH3088.7°58.3°
CARNAQCAPCAN0.8°0.3°
CARNAQCAYCBA89.8°60.3°
CARNAQCAPCAY178.9°179.7°
CARNAQCAPCAX179.3°179.7°
CARNAQCAYCAZ42.0°59.7°
CARNAQCAYH16155.8°179.6°
NAQCARCATH231.1°0.0°
OAOCAMNALCAK21.3°0.0°
OAOCAMCANNAL175.2°180.0°
OAOCAMCANCAP49.6°90.2°
OAOCAMNALH27158.7°179.9°
NALCAKCACH28118.7°120.0°
NALCAKCACH29118.7°119.9°
CAKNALCAMCAN163.5°180.0°
CAKNALCAMH27180.0°180.0°
NALCAKCACCAD103.6°58.1°
NALCAKCACCAB72.3°175.0°
NALCAKH28H29123.7°119.9°
NALCAKCACH30164.3°58.4°
CACCAKNALCAM153.9°180.0°
CAKCACCADCAB175.9°121.7°
CAKCACCADH3092.1°116.5°
CAKCACCADNAE178.1°121.8°
CAKCACCABH3092.0°116.5°
CAKCACCABOAI3.3°58.3°
CAKCACCABCAA178.0°121.8°
CACCAKNALH2726.2°0.0°
CACCAKH28H29123.6°120.1°
CAMCANCAPNAQ179.5°179.7°
CAMCANCAPCAX0.5°0.3°
CANCAMNALH2716.5°0.0°
NALCAMCANCAP125.6°89.8°
CAMNALCAKH2887.4°60.0°
CAMNALCAKH2935.2°60.0°
CANCAPNAQCAX180.0°180.0°
CANCAPNAQCAY179.6°180.0°
CANCAPCAXH2090.0°90.0°
CANCAPCAXH21150.0°30.0°
CANCAPCAXH2230.0°150.0°
CAYCBACBBH15115.3°120.2°
CBACAYNAQCAP88.9°120.0°
CBACAYNAQCAZ131.8°120.0°
CBACAYNAQH16114.5°120.0°
CAYCBACBBCBC154.5°177.5°
CBACAYCAZH16113.6°120.0°
CAYCBACBFH935.3°57.6°
CAYCBACBFH1085.4°62.6°
CAYCBACBBH1386.4°62.5°
CAYCBACBBH1435.4°57.6°
CBACAYCAZH17180.0°60.0°
CBACAYCAZH1860.0°180.0°
CBACAYCAZH1960.0°60.0°
CBBCBACAYNAQ179.0°60.3°
CBACBBCBCH13119.1°120.0°
CBACBBCBCH14119.1°120.0°
CBBCBACAYCAZ49.5°179.7°
CBBCBACBFH989.5°62.2°
CBBCBACBFH10149.8°177.6°
CBACBBCBCH1170.9°60.8°
CBACBBCBCH12169.4°179.2°
CBACBBH13H14122.6°120.2°
CBBCBACAYH1664.1°59.7°
CAPNAQCAYCAZ139.3°120.0°
CAPNAQCAYH1625.6°0.0°
NAQCAPCAXH2090.0°90.0°
NAQCAPCAXH2130.0°150.0°
NAQCAPCAXH22150.0°30.0°
CAYNAQCAPCAX0.4°0.0°
NAQCAYCAZH16114.1°120.0°
NAQCAYCBAH1563.7°59.9°
NAQCAYCAZH1747.6°60.0°
NAQCAYCAZH18167.7°60.0°
NAQCAYCAZH1972.3°180.0°
CADCACCABH3091.9°121.7°
CACCADNAECAF1.6°0.0°
CADCACCABOAI179.5°180.0°
CADCACCABCAA1.8°0.0°
CADCACCAKH2815.1°178.1°
CADCACCAKH29137.7°61.8°
NAECADCACCAB2.2°0.0°
CADNAECAFCAA0.6°0.0°
CADNAECAFCAG179.7°180.0°
NAECADCACH3089.8°121.8°
CAPCAXH20H21120.0°120.0°
CAPCAXH20H22120.0°120.0°
CAPCAXH21H22120.0°119.9°
CBBCBCH11H12119.5°120.0°
CBCCBBH13H14122.6°120.0°
CBCCBBCBAH1539.2°62.3°
CACCABOAICAA178.6°179.9°
CACCABOAICAJ148.5°180.0°
CACCABCAACAF0.9°0.0°
CABCACCAKH28168.9°55.0°
CABCACCAKH2946.4°65.0°
CACCABCAAH34179.1°180.0°
CAZCAYCBAH15164.8°60.1°
CAYCAZH17H18120.1°120.0°
CAYCAZH17H19120.0°120.0°
CAYCAZH18H19120.0°120.0°
NAECAFCAACAB0.2°0.0°
NAECAFCAACAG179.7°179.9°
NAECAFCAGH310.0°0.0°
NAECAFCAGH32120.0°120.0°
NAECAFCAGH33120.0°120.0°
NAECAFCAAH34179.7°180.0°
OAICABCAACAF179.4°180.0°
OAICABCACH3088.6°58.2°
OAICABCAAH340.6°0.1°
CABOAICAJH35180.0°60.0°
CABOAICAJH3660.0°60.0°
CABOAICAJH3760.0°180.0°
CAACABOAICAJ32.9°0.0°
CABCAACAFH34180.0°180.0°
CABCAACAFCAG179.9°180.0°
CAACABCACH3090.1°121.7°
OAICAJH35H36120.0°119.9°
OAICAJH35H37120.0°120.0°
OAICAJH36H37120.0°120.0°
CAACAFCAGH31179.7°180.0°
CAACAFCAGH3259.6°60.0°
CAACAFCAGH3360.3°60.1°
CAFCAGH31H32120.0°120.1°
CAFCAGH31H33120.0°120.0°
CAFCAGH32H33120.0°120.0°
CAGCAFCAAH340.1°0.1°
H1CBKH2H3120.0°120.0°
H7CBECBFH984.5°59.3°
H7CBECBFH1036.1°60.8°
H8CBECBFH935.1°179.2°
H8CBECBFH10155.8°59.1°
H9CBFCBAH15155.5°177.7°
H10CBFCBAH1534.8°57.6°
H11CBCCBBH13170.0°59.1°
H11CBCCBBH1448.2°179.1°
H12CBCCBBH1350.3°60.8°
H12CBCCBBH1471.5°59.2°
H13CBBCBAH15158.3°57.7°
H14CBBCBAH1580.0°177.8°
H15CBACAYH1651.2°179.9°
H16CAYCAZH1766.5°180.0°
H16CAYCAZH1853.6°60.0°
H16CAYCAZH19173.6°60.0°
H17CAZH18H19119.9°120.0°
H20CAXH21H22120.0°120.1°
H23CATCAUH241.3°0.1°
H24CAUCAVH250.5°0.1°
H25CAVCAWH261.1°0.0°
H27NALCAKH2892.6°120.0°
H27NALCAKH29144.8°120.1°
H28CAKCACH3077.0°61.6°
H29CAKCACH3045.6°178.4°
H31CAGH32H33120.0°119.9°
H35CAJH36H37120.0°120.0°

223166

PDB entries from 2024-07-31

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