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JIM

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
CABOAAsing1.43Å1.44Å
OAAHOAAsing0.97Å0.95Å
CABCACsing1.53Å1.53Å
CABHABsing1.09Å1.10Å
CABHABAsing1.09Å1.10Å
CADCACsing1.53Å1.54Å
OAHCACsing1.43Å1.43Å
CACHACsing1.09Å1.10Å
OAECADsing1.45Å1.45Å
CADHADsing1.09Å1.10Å
CADHADAsing1.09Å1.10Å
CAFOAEsing1.34Å1.46Å
OAGCAFdoub1.21Å1.23Å
CAFCAIsing1.51Å1.50Å
OAHHOAHsing0.97Å0.95Å
CAIHAIsing1.09Å1.10Å
CAIHAIAsing1.09Å1.10Å
CAIHAIBsing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
CABOAAHOAA109.5°114.0°
OAACABCAC111.3°109.5°
OAACABHAB108.8°109.4°
OAACABHABA108.8°109.4°
CACCABHAB108.9°109.5°
CACCABHABA108.9°109.5°
CABCACCAD113.8°109.5°
CABCACOAH105.9°109.5°
CABCACHAC108.2°109.5°
HABCABHABA110.1°109.5°
CADCACOAH107.0°109.5°
CADCACHAC107.1°109.4°
CACCADOAE107.7°109.5°
CACCADHAD110.1°109.5°
CACCADHADA110.1°109.5°
OAHCACHAC114.9°109.5°
CACOAHHOAH109.5°114.0°
OAECADHAD110.1°109.5°
OAECADHADA110.1°109.5°
CADOAECAF128.4°117.0°
HADCADHADA108.9°109.4°
OAECAFOAG117.0°120.0°
OAECAFCAI122.0°120.0°
OAGCAFCAI120.9°120.0°
CAFCAIHAI109.5°109.5°
CAFCAIHAIA109.5°109.5°
CAFCAIHAIB109.5°109.5°
HAICAIHAIA109.5°109.5°
HAICAIHAIB109.5°109.5°
HAIACAIHAIB109.5°109.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
OAACABCACHAB120.0°120.0°
OAACABCACHABA120.0°120.0°
OAACABHABHABA119.2°119.9°
OAACABCACCAD134.1°175.0°
OAACABCACOAH108.5°65.0°
OAACABCACHAC15.2°55.0°
HOAAOAACABCAC180.0°180.0°
HOAAOAACABHAB60.0°60.0°
HOAAOAACABHABA60.0°60.0°
CACCABHABHABA119.3°120.1°
CABCACCADOAH116.7°120.0°
CABCACCADHAC119.6°120.0°
CABCACOAHHAC119.4°120.0°
CABCACCADOAE119.5°175.0°
CABCACCADHAD0.5°65.0°
CABCACCADHADA120.5°55.0°
CABCACOAHHOAH180.0°60.0°
HABCABCACCAD105.9°65.0°
HABCABCACOAH11.5°55.0°
HABCABCACHAC135.1°175.0°
HABACABCACCAD14.1°55.0°
HABACABCACOAH131.5°175.0°
HABACABCACHAC104.8°64.9°
CADCACOAHHAC118.8°120.0°
CACCADOAEHAD120.0°120.0°
CACCADOAEHADA120.0°120.0°
CACCADHADHADA120.7°120.0°
CACCADOAECAF159.6°180.0°
CADCACOAHHOAH58.2°60.0°
OAHCACCADOAE2.7°65.0°
OAHCACCADHAD117.2°55.0°
OAHCACCADHADA122.8°175.0°
HACCACCADOAE121.0°55.0°
HACCACCADHAD119.1°175.0°
HACCACCADHADA1.0°65.0°
HACCACOAHHOAH60.6°180.0°
OAECADHADHADA120.7°120.0°
CADOAECAFOAG176.4°0.0°
CADOAECAFCAI2.5°180.0°
HADCADOAECAF80.4°60.0°
HADACADOAECAF39.6°60.0°
OAECAFOAGCAI178.9°179.9°
OAECAFCAIHAI178.9°90.0°
OAECAFCAIHAIA61.1°150.0°
OAECAFCAIHAIB58.9°30.1°
OAGCAFCAIHAI0.0°90.0°
OAGCAFCAIHAIA120.0°30.1°
OAGCAFCAIHAIB120.0°150.0°
CAFCAIHAIHAIA120.0°120.1°
CAFCAIHAIHAIB120.0°120.0°
CAFCAIHAIAHAIB120.0°120.0°
HAICAIHAIAHAIB120.0°119.9°

226262

PDB entries from 2024-10-16

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