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A8U

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
CARCAQdoub1.36Å1.39ÅAromatic
CARCALsing1.41Å1.38ÅAromatic
CAQCAPsing1.41Å1.40ÅAromatic
CAMCALdoub1.40Å1.39ÅAromatic
CAMCANsing1.36Å1.41ÅAromatic
CALCAKsing1.42Å1.38ÅAromatic
CBBCBCdoub1.38Å1.39ÅAromatic
CBBCBAsing1.39Å1.38ÅAromatic
CATCAAsing1.53Å1.52Å
CAPCBAsing1.48Å1.39Å
CAPNAOdoub1.32Å1.33ÅAromatic
CANCAIdoub1.41Å1.39ÅAromatic
CBCCBDsing1.38Å1.39ÅAromatic
CBACBFdoub1.39Å1.40ÅAromatic
CAKNAOsing1.34Å1.33ÅAromatic
CAKCAJdoub1.40Å1.38ÅAromatic
CAACAFsing1.53Å1.49Å
CAANABsing1.47Å1.53Å
NBJCBGsing1.47Å1.47Å
CAICAJsing1.38Å1.38ÅAromatic
CAICAGsing1.48Å1.36Å
CBDCBGsing1.51Å1.38Å
CBDCBEdoub1.38Å1.39ÅAromatic
OAWCAUdoub1.21Å1.24Å
CBFCBEsing1.38Å1.38ÅAromatic
CAFNAEsing1.47Å1.48Å
CBGCBHsing1.53Å1.53Å
CBGCBIsing1.53Å1.50Å
CAYCAZsing1.53Å1.51Å
CAYCAXsing1.53Å1.52Å
NABCAUsing1.35Å1.33Å
NABCACsing1.47Å1.50Å
CAUOAVsing1.35Å1.37Å
NAECAGsing1.35Å1.32Å
NAECADsing1.47Å1.50Å
CAGOAHdoub1.22Å1.26Å
CACCADsing1.53Å1.53Å
CBHCBIsing1.53Å1.52Å
CAXOAVsing1.45Å1.44Å
CAAH1sing1.09Å1.10Å
CACH2sing1.09Å1.10Å
CACH3sing1.09Å1.10Å
CADH4sing1.09Å1.10Å
CADH5sing1.09Å1.10Å
CAFH6sing1.09Å1.10Å
CAFH7sing1.09Å1.10Å
CAJH8sing1.08Å1.08Å
CAMH9sing1.08Å1.08Å
CANH10sing1.08Å1.08Å
CAQH11sing1.08Å1.08Å
CARH12sing1.08Å1.08Å
CATH13sing1.09Å1.10Å
CATH14sing1.09Å1.10Å
CATH15sing1.09Å1.10Å
CAXH16sing1.09Å1.10Å
CAXH17sing1.09Å1.10Å
CAYH18sing1.09Å1.10Å
CAYH19sing1.09Å1.10Å
CAZH20sing1.09Å1.10Å
CAZH21sing1.09Å1.10Å
CAZH22sing1.09Å1.10Å
CBBH23sing1.08Å1.08Å
CBCH24sing1.08Å1.08Å
CBEH25sing1.08Å1.08Å
CBFH26sing1.08Å1.08Å
CBHH27sing1.09Å1.10Å
CBHH28sing1.09Å1.10Å
CBIH29sing1.09Å1.10Å
CBIH30sing1.09Å1.10Å
NBJH31sing1.01Å1.00Å
NBJH32sing1.01Å1.00Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
CAQCARCAL119.9°118.3°
CARCAQCAP119.2°119.8°
CARCAQH11120.4°120.1°
CAQCARH12120.1°120.8°
CARCALCAM124.1°121.0°
CARCALCAK116.9°119.1°
CALCARH12120.1°120.9°
CAQCAPCBA124.3°119.2°
CAQCAPNAO119.4°121.5°
CAPCAQH11120.4°120.0°
CALCAMCAN118.5°120.0°
CAMCALCAK119.1°119.9°
CALCAMH9120.7°120.0°
CAMCANCAI121.8°120.8°
CANCAMH9120.8°120.0°
CAMCANH10119.1°119.7°
CALCAKNAO123.6°120.0°
CALCAKCAJ120.6°119.2°
CBCCBBCBA120.2°119.8°
CBBCBCCBD119.8°120.2°
CBCCBBH23119.9°120.1°
CBBCBCH24120.1°119.9°
CBBCBACAP123.6°120.1°
CBBCBACBF119.2°119.8°
CBACBBH23119.9°120.1°
CATCAACAF111.3°109.6°
CATCAANAB112.9°109.6°
CATCAAH1109.1°109.7°
CAACATH13109.5°109.5°
CAACATH14109.4°109.5°
CAACATH15109.5°109.5°
CBACAPNAO114.7°119.3°
CAPCBACBF116.9°120.1°
CAPNAOCAK120.3°121.3°
CANCAICAJ115.8°120.5°
CANCAICAG121.1°119.7°
CAICANH10119.1°119.6°
CBCCBDCBG120.0°119.9°
CBCCBDCBE120.5°120.2°
CBDCBCH24120.1°119.9°
CBACBFCBE120.9°119.9°
CBACBFH26119.6°120.1°
NAOCAKCAJ115.8°120.8°
CAKCAJCAI121.5°119.5°
CAKCAJH8119.3°120.2°
CAFCAANAB105.1°108.6°
CAACAFNAE111.6°108.7°
CAFCAAH1109.4°109.6°
CAACAFH6108.9°109.6°
CAACAFH7108.9°109.7°
CAANABCAU120.1°120.6°
CAANABCAC113.0°118.8°
NABCAAH1108.9°109.6°
NBJCBGCBD117.3°115.6°
NBJCBGCBH117.8°117.5°
NBJCBGCBI117.0°117.5°
CBGNBJH31109.5°111.0°
CBGNBJH32109.4°111.0°
CAJCAICAG118.8°119.7°
CAICAJH8119.3°120.2°
CAICAGNAE117.6°120.0°
CAICAGOAH112.4°120.0°
CBGCBDCBE119.5°119.9°
CBDCBGCBH118.0°117.5°
CBDCBGCBI113.7°117.5°
CBDCBECBF119.3°120.1°
CBDCBEH25120.4°119.9°
OAWCAUNAB118.3°120.0°
OAWCAUOAV119.9°120.0°
CBFCBEH25120.4°120.0°
CBECBFH26119.6°120.0°
CAFNAECAG116.9°120.6°
CAFNAECAD109.5°118.8°
NAECAFH6108.9°109.6°
NAECAFH7108.9°109.6°
CBHCBGCBI60.4°60.0°
CBGCBHCBI59.1°60.0°
CBGCBHH27120.2°117.5°
CBGCBHH28120.2°117.5°
CBGCBICBH60.6°60.0°
CBGCBIH29119.9°117.5°
CBGCBIH30119.9°117.5°
CAZCAYCAX108.2°109.5°
CAZCAYH18109.8°109.4°
CAZCAYH19109.8°109.5°
CAYCAZH20109.5°109.5°
CAYCAZH21109.5°109.5°
CAYCAZH22109.5°109.5°
CAYCAXOAV111.1°109.5°
CAYCAXH16109.1°109.5°
CAYCAXH17109.0°109.5°
CAXCAYH18109.8°109.5°
CAXCAYH19109.8°109.5°
CAUNABCAC125.0°120.6°
NABCAUOAV119.6°120.0°
NABCACCAD110.4°108.6°
NABCACH2109.2°109.6°
NABCACH3109.2°109.8°
CAUOAVCAX113.5°117.0°
CAGNAECAD120.1°120.6°
NAECAGOAH118.2°120.0°
NAECADCAC105.7°108.6°
NAECADH4110.4°109.6°
NAECADH5110.4°109.7°
CADCACH2109.2°109.6°
CADCACH3109.2°109.6°
CACCADH4110.4°109.7°
CACCADH5110.4°109.6°
CBICBHH27120.2°117.5°
CBICBHH28120.2°117.5°
CBHCBIH29119.9°117.5°
CBHCBIH30119.9°117.5°
OAVCAXH16109.0°109.5°
OAVCAXH17109.0°109.4°
H2CACH3109.4°109.7°
H4CADH5109.5°109.7°
H6CAFH7109.5°109.7°
H13CATH14109.5°109.5°
H13CATH15109.4°109.5°
H14CATH15109.5°109.4°
H16CAXH17109.5°109.5°
H18CAYH19109.5°109.5°
H20CAZH21109.5°109.5°
H20CAZH22109.5°109.5°
H21CAZH22109.5°109.4°
H27CBHH28109.4°115.5°
H29CBIH30109.5°115.5°
H31NBJH32109.5°111.0°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
CAQCARCALH12180.0°180.0°
CARCAQCAPH11180.0°180.0°
CAQCARCALCAM179.8°180.0°
CAQCARCALCAK0.7°0.0°
CARCAQCAPCBA174.0°180.0°
CARCAQCAPNAO8.9°0.0°
CALCARCAQCAP4.0°0.0°
CARCALCAMCAK179.5°180.0°
CARCALCAMCAN179.9°179.7°
CARCALCAKNAO2.4°0.1°
CARCALCAKCAJ175.1°180.0°
CARCALCAMH90.1°0.1°
CALCARCAQH11176.0°180.0°
CAQCAPCBACBB29.9°0.3°
CAQCAPCBANAO165.7°180.0°
CAQCAPCBACBF155.8°180.0°
CAQCAPNAOCAK10.6°0.1°
CAPCAQCARH12176.1°180.0°
CALCAMCANH9180.0°179.7°
CALCAMCANCAI5.3°0.5°
CAMCALCAKNAO178.1°179.9°
CAMCALCAKCAJ4.4°0.0°
CALCAMCANH10174.7°180.0°
CAMCALCARH120.2°0.0°
CANCAMCALCAK0.4°0.2°
CAMCANCAIH10180.0°179.5°
CAMCANCAICAJ15.3°0.5°
CAMCANCAICAG171.6°179.7°
CALCAKNAOCAP7.6°0.1°
CALCAKNAOCAJ177.6°179.9°
CALCAKCAJCAI15.5°0.0°
CALCAKCAJH8164.5°180.0°
CAKCALCAMH9179.6°179.9°
CAKCALCARH12179.3°179.9°
CBCCBBCBAH23180.0°180.0°
CBCCBBCBACAP178.1°180.0°
CBBCBCCBDH24180.0°180.0°
CBCCBBCBACBF3.9°0.3°
CBBCBCCBDCBG179.9°180.0°
CBBCBCCBDCBE0.1°0.0°
CBBCBACAPCBF174.3°179.7°
CBBCBACAPNAO164.4°179.6°
CBACBBCBCCBD1.1°0.0°
CBBCBACBFCBE5.7°0.5°
CBACBBCBCH24178.9°180.0°
CBBCBACBFH26174.2°179.7°
CATCAACAFNAB122.5°119.7°
CATCAACAFH1120.6°120.5°
CATCAANABH1121.4°120.5°
CATCAACAFNAE62.1°169.2°
CATCAANABCAU99.7°5.1°
CATCAANABCAC65.3°175.0°
CATCAACAFH658.2°49.4°
CATCAACAFH7177.6°71.1°
CAACATH13H14120.0°120.0°
CAACATH13H15120.0°120.0°
CAACATH14H15120.0°119.9°
CBACAPNAOCAK177.1°180.0°
CAPCBACBFCBE179.7°179.8°
CBACAPCAQH116.0°0.0°
CAPCBACBBH231.9°0.1°
CAPCBACBFH260.3°0.0°
NAOCAPCBACBF9.9°0.0°
CAPNAOCAKCAJ170.0°180.0°
NAOCAPCAQH11171.0°180.0°
CANCAICAJCAK20.3°0.3°
CANCAICAJCAG156.9°179.7°
CANCAICAGNAE57.9°42.6°
CANCAICAGOAH84.4°137.3°
CANCAICAJH8159.7°179.8°
CAICANCAMH9174.7°179.8°
CBCCBDCBGNBJ16.9°4.3°
CBCCBDCBGCBE180.0°180.0°
CBCCBDCBECBF1.7°0.2°
CBCCBDCBGCBH167.3°150.0°
CBCCBDCBGCBI124.9°141.4°
CBDCBCCBBH23178.9°180.0°
CBCCBDCBEH25178.3°180.0°
CBACBFCBECBD4.6°0.5°
CBACBFCBEH26180.0°179.8°
CBFCBACBBH23176.1°179.7°
CBACBFCBEH25175.4°179.7°
NAOCAKCAJCAI166.8°179.9°
NAOCAKCAJH813.2°0.0°
CAKCAJCAIH8180.0°180.0°
CAKCAJCAICAG177.2°180.0°
CAFCAANABH1117.2°119.8°
CAACAFNAEH6120.3°119.8°
CAACAFNAEH7120.3°119.8°
CAFCAANABCAU138.8°124.8°
CAFCAANABCAC56.2°55.3°
CAACAFNAECAG151.2°124.7°
CAACAFNAECAD67.8°55.2°
CAACAFH6H7119.0°120.5°
CAFCAACATH13180.0°63.7°
CAFCAACATH1460.0°176.2°
CAFCAACATH1560.0°56.3°
CAANABCAUOAW16.3°6.0°
NABCAACAFNAE60.4°49.4°
CAANABCAUCAC163.1°179.9°
CAANABCAUOAV179.6°174.0°
CAANABCACCAD57.8°55.2°
CAANABCACH2178.0°174.9°
CAANABCACH362.3°64.6°
NABCAACAFH6179.2°70.3°
NABCAACAFH759.9°169.2°
NABCAACATH1362.1°55.5°
NABCAACATH14177.9°64.6°
NABCAACATH1557.9°175.5°
NBJCBGCBDCBH150.4°145.7°
NBJCBGCBDCBI141.8°145.6°
NBJCBGCBDCBE163.1°175.7°
NBJCBGCBHCBI106.9°107.5°
NBJCBGCBHH272.3°0.0°
NBJCBGCBHH28143.8°145.0°
NBJCBGCBIH29142.3°145.0°
NBJCBGCBIH301.5°0.1°
CBGNBJH31H32120.0°123.9°
CAJCAICAGNAE146.5°137.6°
CAJCAICAGOAH71.2°42.4°
CAJCAICANH10164.7°180.0°
CAICAGNAECAF45.6°4.5°
CAICAGNAEOAH140.1°180.0°
CAICAGNAECAD177.7°175.5°
CAGCAICAJH82.8°0.0°
CAGCAICANH108.4°0.2°
CBGCBDCBECBF178.3°179.8°
CBDCBGCBHCBI102.8°107.5°
CBGCBDCBCH240.1°0.0°
CBGCBDCBEH251.7°0.0°
CBDCBGCBHH27148.0°145.0°
CBDCBGCBHH286.4°0.0°
CBDCBGCBIH290.3°0.1°
CBDCBGCBIH30140.4°145.0°
CBDCBGNBJH31180.0°34.4°
CBDCBGNBJH3260.0°89.5°
CBDCBECBFH25180.0°179.8°
CBECBDCBGCBH12.7°30.0°
CBECBDCBGCBI55.1°38.7°
CBECBDCBCH24179.9°180.0°
CBDCBECBFH26175.4°179.7°
OAWCAUNABOAV163.3°180.0°
OAWCAUNABCAC179.4°173.9°
OAWCAUOAVCAX12.1°0.1°
CAFNAECAGCAD136.7°179.9°
CAFNAECAGOAH174.3°175.5°
CAFNAECADCAC62.6°55.2°
NAECAFCAAH1177.3°70.3°
CAFNAECADH4178.0°175.0°
CAFNAECADH556.8°64.6°
NAECAFH6H7119.0°120.3°
CBGCBHCBIH27109.2°107.5°
CBGCBHCBIH28109.2°107.5°
CBGCBHH27H28145.2°145.7°
CBHCBGCBIH29109.6°107.5°
CBHCBGCBIH30109.6°107.4°
CBHCBGNBJH3129.5°179.9°
CBHCBGNBJH32149.5°56.2°
CBGCBIH29H30144.4°145.8°
CBICBGNBJH3139.5°111.3°
CBICBGNBJH3280.5°124.8°
CAZCAYCAXH18119.8°120.0°
CAZCAYCAXH19119.8°120.0°
CAZCAYCAXOAV61.7°180.0°
CAZCAYCAXH16178.0°60.0°
CAZCAYCAXH1758.5°60.0°
CAZCAYH18H19120.6°120.0°
CAYCAZH20H21120.0°120.1°
CAYCAZH20H22120.0°120.0°
CAYCAZH21H22120.0°120.0°
CAYCAXOAVCAU78.3°180.0°
CAYCAXOAVH16120.3°120.1°
CAYCAXOAVH17120.2°120.0°
CAYCAXH16H17119.2°120.0°
CAXCAYH18H19120.6°120.0°
CAXCAYCAZH20180.0°60.1°
CAXCAYCAZH2160.0°60.0°
CAXCAYCAZH2260.0°180.0°
CAUNABCACCAD138.0°124.8°
NABCAUOAVCAX175.2°180.0°
CAUNABCAAH121.7°115.4°
CAUNABCACH217.9°5.1°
CAUNABCACH3101.8°115.4°
CACNABCAUOAV17.3°6.1°
NABCACCADNAE58.1°49.4°
NABCACCADH2120.2°119.7°
NABCACCADH3120.1°119.9°
CACNABCAAH1173.3°64.5°
NABCACH2H3119.5°120.6°
NABCACCADH4177.5°169.1°
NABCACCADH561.3°70.4°
CAUOAVCAXH1641.9°59.9°
CAUOAVCAXH17161.4°60.0°
CAGNAECADCAC157.9°124.7°
CAGNAECADH438.5°4.9°
CAGNAECADH582.7°115.5°
CAGNAECAFH630.9°115.5°
CAGNAECAFH788.5°4.9°
CADNAECAGOAH37.6°4.6°
NAECADCACH4119.4°119.7°
NAECADCACH5119.4°119.9°
NAECADCACH2178.2°169.2°
NAECADCACH362.1°70.5°
NAECADH4H5121.7°120.5°
CADNAECAFH6171.9°64.6°
CADNAECAFH752.5°175.0°
CADCACH2H3119.6°120.3°
CACCADH4H5121.7°120.4°
CBICBHH27H28145.2°145.7°
CBHCBIH29H30144.4°145.6°
OAVCAXH16H17119.2°119.9°
OAVCAXCAYH1858.1°60.1°
OAVCAXCAYH19178.5°60.0°
H1CAACAFH662.4°169.9°
H1CAACAFH757.0°49.4°
H1CAACATH1359.2°175.9°
H1CAACATH1460.8°55.8°
H1CAACATH15179.2°64.1°
H2CACCADH462.4°71.1°
H2CACCADH558.8°49.3°
H3CACCADH457.3°49.2°
H3CACCADH5178.5°169.6°
H9CAMCANH105.3°0.3°
H11CAQCARH124.0°0.0°
H13CATH14H15120.0°120.0°
H16CAXCAYH1862.2°60.0°
H16CAXCAYH1958.2°180.0°
H17CAXCAYH18178.3°180.0°
H17CAXCAYH1961.3°60.0°
H18CAYCAZH2060.2°180.0°
H18CAYCAZH2159.8°59.9°
H18CAYCAZH22179.8°60.0°
H19CAYCAZH2060.2°60.0°
H19CAYCAZH21179.8°179.9°
H19CAYCAZH2259.8°60.0°
H20CAZH21H22120.0°120.0°
H23CBBCBCH241.1°0.0°
H25CBECBFH264.6°0.1°
H27CBHCBIH29141.1°145.0°
H27CBHCBIH300.4°0.0°
H28CBHCBIH290.4°0.0°
H28CBHCBIH30141.2°145.0°

217705

PDB entries from 2024-03-27

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