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SummaryGeometryRelated PDB entries

JTE

Bonds
First atomSecond atomBond order typeDistance
(experimental model)		Distance
(ideal model)		Properties
CAACABsing1.51Å1.53Å
CACCABdoub1.38Å1.39ÅAromatic
CACCADsing1.38Å1.47ÅAromatic
CAECADsing1.51Å1.49Å
CABCAFsing1.38Å1.40ÅAromatic
CADCAHdoub1.38Å1.39ÅAromatic
CAFCAGdoub1.39Å1.41ÅAromatic
CAHCAGsing1.39Å1.41ÅAromatic
CAGCAJsing1.48Å1.43Å
CAJCAIdoub1.39Å1.45ÅAromatic
CAJCAKsing1.40Å1.37ÅAromatic
CAICAMsing1.38Å1.43ÅAromatic
FALCAKsing1.35Å1.61Å
CAKCAOdoub1.38Å1.46ÅAromatic
CAMCANdoub1.38Å1.40ÅAromatic
CAOCANsing1.38Å1.40ÅAromatic
CANCAPsing1.51Å1.43Å
CAPCAQsing1.53Å1.57Å
CAPCARsing1.51Å1.55Å
OASCARdoub1.21Å1.25Å
CAROATsing1.34Å1.25Å
OATH1sing0.97Å0.95Å
CAPH2sing1.09Å1.10Å
CAQH3sing1.09Å1.10Å
CAQH4sing1.09Å1.10Å
CAQH5sing1.09Å1.10Å
CAOH6sing1.08Å1.08Å
CAMH7sing1.08Å1.08Å
CAIH8sing1.08Å1.08Å
CAHH9sing1.08Å1.08Å
CAEH10sing1.09Å1.10Å
CAEH11sing1.09Å1.10Å
CAEH12sing1.09Å1.10Å
CACH13sing1.08Å1.08Å
CAAH14sing1.09Å1.10Å
CAAH15sing1.09Å1.10Å
CAAH16sing1.09Å1.10Å
CAFH17sing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)		Angle
(ideal model)
CAACABCAC121.1°119.9°
CAACABCAF119.9°120.0°
CABCAAH14109.5°109.5°
CABCAAH15109.5°109.5°
CABCAAH16109.5°109.5°
CABCACCAD119.9°120.2°
CACCABCAF119.0°120.1°
CABCACH13120.0°119.9°
CACCADCAE120.5°120.0°
CACCADCAH119.8°120.1°
CADCACH13120.0°119.9°
CAECADCAH119.7°119.9°
CADCAEH10109.5°109.4°
CADCAEH11109.5°109.4°
CADCAEH12109.5°109.5°
CABCAFCAG121.6°119.9°
CABCAFH17119.2°120.1°
CADCAHCAG119.3°119.8°
CADCAHH9120.4°120.1°
CAFCAGCAH120.3°119.8°
CAFCAGCAJ116.6°120.1°
CAGCAFH17119.2°120.1°
CAHCAGCAJ123.0°120.1°
CAGCAHH9120.4°120.1°
CAGCAJCAI120.5°120.1°
CAGCAJCAK119.9°120.2°
CAICAJCAK119.3°119.7°
CAJCAICAM120.1°119.9°
CAJCAIH8119.9°120.1°
CAJCAKFAL119.8°120.1°
CAJCAKCAO120.0°119.8°
CAICAMCAN120.1°120.1°
CAICAMH7120.0°119.9°
CAMCAIH8120.0°120.0°
FALCAKCAO120.2°120.1°
CAKCAOCAN120.8°120.1°
CAKCAOH6119.6°120.0°
CAMCANCAO119.7°120.3°
CAMCANCAP120.6°119.8°
CANCAMH7120.0°120.0°
CAOCANCAP119.7°119.9°
CANCAOH6119.6°119.9°
CANCAPCAQ108.0°109.5°
CANCAPCAR111.5°109.5°
CANCAPH2110.3°109.5°
CAQCAPCAR109.9°109.5°
CAQCAPH2108.4°109.4°
CAPCAQH3109.5°109.5°
CAPCAQH4109.5°109.5°
CAPCAQH5109.5°109.5°
CAPCAROAS117.3°120.0°
CAPCAROAT117.0°120.0°
CARCAPH2108.7°109.5°
OASCAROAT125.7°120.0°
CAROATH1109.5°116.9°
H3CAQH4109.5°109.4°
H3CAQH5109.5°109.5°
H4CAQH5109.5°109.5°
H10CAEH11109.5°109.4°
H10CAEH12109.4°109.5°
H11CAEH12109.5°109.5°
H14CAAH15109.5°109.4°
H14CAAH16109.4°109.5°
H15CAAH16109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)		Torsion
(ideal model)
CAACABCACCAF178.5°179.6°
CAACABCACCAD178.8°180.0°
CAACABCAFCAG179.7°179.7°
CAACABCACH131.1°0.4°
CABCAAH14H15120.0°120.0°
CABCAAH14H16120.0°120.0°
CABCAAH15H16120.0°120.0°
CAACABCAFH170.3°0.3°
CABCACCADH13180.0°179.6°
CABCACCADCAE179.5°179.9°
CABCACCADCAH0.2°0.0°
CACCABCAFCAG1.8°0.6°
CACCABCAAH1489.2°90.0°
CACCABCAAH15150.8°150.1°
CACCABCAAH1630.8°30.0°
CACCABCAFH17178.2°180.0°
CACCADCAECAH179.7°180.0°
CADCACCABCAF0.3°0.3°
CACCADCAHCAG0.6°0.0°
CACCADCAHH9179.4°180.0°
CACCADCAEH1090.1°89.9°
CACCADCAEH11149.8°29.9°
CACCADCAEH1229.8°150.0°
CAECADCAHCAG179.7°179.9°
CAECADCAHH90.3°0.0°
CADCAEH10H11120.0°119.9°
CADCAEH10H12120.0°120.1°
CADCAEH11H12120.0°120.1°
CAECADCACH130.5°0.3°
CABCAFCAGH17180.0°179.4°
CABCAFCAGCAH2.7°0.6°
CABCAFCAGCAJ179.8°179.7°
CAFCABCACH13179.7°180.0°
CAFCABCAAH1489.3°89.6°
CAFCABCAAH1530.7°30.3°
CAFCABCAAH16150.7°150.3°
CADCAHCAGCAF2.0°0.3°
CADCAHCAGH9180.0°180.0°
CADCAHCAGCAJ179.0°180.0°
CAHCADCAEH1090.2°90.1°
CAHCADCAEH1129.9°150.1°
CAHCADCAEH12149.9°30.0°
CAHCADCACH13179.8°179.7°
CAFCAGCAHCAJ177.0°179.6°
CAFCAGCAJCAI41.9°50.3°
CAFCAGCAJCAK132.3°129.5°
CAFCAGCAHH9178.0°179.7°
CAHCAGCAJCAI141.1°130.0°
CAHCAGCAJCAK44.8°50.2°
CAHCAGCAFH17177.3°180.0°
CAGCAJCAICAK174.2°179.8°
CAGCAJCAICAM176.8°180.0°
CAGCAJCAKFAL4.3°0.1°
CAGCAJCAKCAO176.9°180.0°
CAGCAJCAIH83.1°0.1°
CAJCAGCAHH91.1°0.1°
CAJCAGCAFH170.2°0.3°
CAJCAICAMH8180.0°179.9°
CAICAJCAKFAL178.6°179.7°
CAICAJCAKCAO2.7°0.2°
CAJCAICAMCAN0.7°0.0°
CAJCAICAMH7179.4°180.0°
CAKCAJCAICAM2.7°0.2°
CAJCAKFALCAO178.8°180.0°
CAJCAKCAOCAN0.8°0.0°
CAJCAKCAOH6179.2°180.0°
CAKCAJCAIH8177.3°179.7°
CAICAMCANH7180.0°180.0°
CAICAMCANCAO1.3°0.2°
CAICAMCANCAP178.6°180.0°
FALCAKCAOCAN179.5°179.9°
FALCAKCAOH60.5°0.1°
CAKCAOCANCAM1.2°0.2°
CAKCAOCANH6180.0°180.0°
CAKCAOCANCAP178.6°180.0°
CAMCANCAOCAP177.3°179.7°
CAMCANCAPCAQ110.5°60.3°
CAMCANCAPCAR128.7°59.7°
CAMCANCAPH27.8°179.8°
CAMCANCAOH6178.7°179.8°
CANCAMCAIH8179.3°179.9°
CAOCANCAPCAQ66.8°120.0°
CAOCANCAPCAR54.0°120.0°
CAOCANCAPH2174.8°0.0°
CAOCANCAMH7178.7°179.7°
CANCAPCAQCAR121.8°120.0°
CANCAPCAQH2119.5°120.0°
CANCAPCARH2121.8°120.1°
CANCAPCAROAS40.1°0.1°
CANCAPCAROAT140.7°179.7°
CANCAPCAQH3180.0°60.0°
CANCAPCAQH460.0°180.0°
CANCAPCAQH560.0°60.0°
CAPCANCAOH61.4°0.0°
CAPCANCAMH71.4°0.0°
CAQCAPCARH2118.5°120.0°
CAQCAPCAROAS159.8°120.1°
CAQCAPCAROAT21.0°60.3°
CAPCAQH3H4120.0°120.0°
CAPCAQH3H5120.0°120.0°
CAPCAQH4H5120.0°120.0°
CAPCAROASOAT179.1°179.6°
CAPCAROATH1179.1°179.7°
CARCAPCAQH358.1°60.0°
CARCAPCAQH4178.2°60.0°
CARCAPCAQH561.8°180.0°
OASCAROATH10.0°0.1°
OASCARCAPH281.7°120.0°
OATCARCAPH297.5°59.6°
H2CAPCAQH360.5°180.0°
H2CAPCAQH459.5°60.0°
H2CAPCAQH5179.5°60.0°
H3CAQH4H5120.0°119.9°
H7CAMCAIH80.7°0.0°
H10CAEH11H12120.0°120.0°
H14CAAH15H16120.0°120.0°

218500

PDB entries from 2024-04-17

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