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35J

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
CAJSABdoub1.60Å1.63Å
CAJNAIsing1.35Å1.34Å
NAICAGsing1.46Å1.47Å
CAGCAKsing1.51Å1.39Å
CAECAKdoub1.39Å1.39ÅAromatic
CAECACsing1.39Å1.39ÅAromatic
CAKCAFsing1.38Å1.39ÅAromatic
CACCADdoub1.38Å1.39ÅAromatic
CAFNAHdoub1.32Å1.40ÅAromatic
CADNAHsing1.32Å1.40ÅAromatic
CAJH1sing1.08Å1.08Å
CAGH3sing1.09Å1.10Å
CAGH4sing1.09Å1.10Å
CAEH5sing1.08Å1.08Å
CACH6sing1.08Å1.08Å
CADH7sing1.08Å1.08Å
CAFH8sing1.08Å1.08Å
NAIH2sing0.97Å1.00Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
SABCAJNAI120.0°120.0°
SABCAJH1120.0°119.9°
CAJNAICAG122.0°120.0°
NAICAJH1120.0°120.0°
CAJNAIH2119.0°119.9°
NAICAGCAK109.5°109.4°
NAICAGH3109.5°109.5°
NAICAGH4109.5°109.5°
CAGNAIH2119.0°120.1°
CAGCAKCAE119.9°120.4°
CAGCAKCAF120.0°120.4°
CAKCAGH3109.5°109.4°
CAKCAGH4109.5°109.5°
CAKCAECAC120.3°118.4°
CAECAKCAF120.1°119.2°
CAKCAEH5119.9°120.8°
CAECACCAD120.1°119.2°
CACCAEH5119.9°120.8°
CAECACH6119.9°120.4°
CAKCAFNAH119.9°120.7°
CAKCAFH8120.0°119.6°
CACCADNAH119.9°120.7°
CADCACH6120.0°120.4°
CACCADH7120.1°119.7°
CAFNAHCAD119.8°121.8°
NAHCAFH8120.0°119.7°
NAHCADH7120.1°119.6°
H3CAGH4109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
SABCAJNAIH1180.0°179.7°
SABCAJNAICAG0.0°0.0°
SABCAJNAIH2180.0°180.0°
CAJNAICAGH2180.0°180.0°
CAJNAICAGCAK139.7°180.0°
CAJNAICAGH319.6°60.0°
CAJNAICAGH4100.3°60.0°
NAICAGCAKH3120.0°120.0°
NAICAGCAKH4120.0°120.0°
NAICAGCAKCAE64.0°89.8°
NAICAGCAKCAF116.0°90.0°
CAGNAICAJH1180.0°179.7°
NAICAGH3H4120.0°120.0°
CAGCAKCAECAF179.9°179.8°
CAGCAKCAECAC180.0°180.0°
CAGCAKCAFNAH179.9°179.7°
CAKCAGH3H4120.0°120.0°
CAGCAKCAEH50.0°0.0°
CAGCAKCAFH80.0°0.0°
CAKCAGNAIH240.3°0.0°
CAKCAECACH5180.0°180.0°
CAKCAECACCAD0.0°0.1°
CAECAKCAFNAH0.0°0.5°
CAECAKCAGH356.0°150.3°
CAECAKCAGH4176.0°30.2°
CAKCAECACH6180.0°180.0°
CAECAKCAFH8180.0°179.8°
CACCAECAKCAF0.0°0.2°
CAECACCADH6180.0°179.9°
CAECACCADNAH0.0°0.1°
CAECACCADH7180.0°180.0°
CAKCAFNAHH8180.0°179.8°
CAKCAFNAHCAD0.0°0.5°
CAFCAKCAGH3124.0°30.0°
CAFCAKCAGH44.0°150.0°
CAFCAKCAEH5180.0°179.8°
CACCADNAHCAF0.0°0.2°
CACCADNAHH7180.0°179.9°
CADCACCAEH5180.0°179.9°
CAFNAHCADH7179.9°179.7°
NAHCADCACH6180.0°180.0°
CADNAHCAFH8180.0°179.8°
H1CAJNAIH20.0°0.3°
H3CAGNAIH2160.4°119.9°
H4CAGNAIH279.7°120.0°
H5CAECACH60.0°0.0°
H6CACCADH70.1°0.1°

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PDB entries from 2024-07-17

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