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M3E

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
OABCANdoub1.22Å1.39Å
CANNAJsing1.35Å1.35Å
CANNAIsing1.35Å1.33Å
NAJCAMsing1.35Å1.33Å
NAICALsing1.38Å1.34Å
CAMOAAdoub1.22Å1.44Å
CAMCAHsing1.41Å1.39Å
CALCAHdoub1.37Å1.41Å
CALCAKsing1.48Å1.49Å
CAFCAKdoub1.40Å1.38ÅAromatic
CAFCADsing1.38Å1.36ÅAromatic
CAKCAGsing1.40Å1.39ÅAromatic
CADCACdoub1.38Å1.38ÅAromatic
CAGCAEdoub1.38Å1.37ÅAromatic
CACCAEsing1.38Å1.38ÅAromatic
CACH1sing1.08Å1.08Å
CADH2sing1.08Å1.08Å
CAEH3sing1.08Å1.08Å
CAFH4sing1.08Å1.08Å
CAGH5sing1.08Å1.08Å
CAHH6sing1.08Å1.08Å
NAJH8sing0.97Å1.00Å
NAIH7sing0.97Å1.00Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
OABCANNAJ117.1°119.4°
OABCANNAI121.0°119.5°
NAJCANNAI121.8°121.1°
CANNAJCAM120.0°120.6°
CANNAJH8120.0°119.7°
CANNAICAL120.9°120.4°
CANNAIH7119.6°119.8°
NAJCAMOAA119.5°120.2°
NAJCAMCAH120.1°119.5°
CAMNAJH8120.0°119.7°
NAICALCAH118.7°119.4°
NAICALCAK121.7°120.4°
CALNAIH7119.5°119.8°
OAACAMCAH120.3°120.2°
CAMCAHCAL118.3°119.0°
CAMCAHH6120.8°120.5°
CAHCALCAK119.6°120.3°
CALCAHH6120.9°120.5°
CALCAKCAF119.6°120.1°
CALCAKCAG120.6°120.2°
CAKCAFCAD120.1°119.8°
CAFCAKCAG119.8°119.7°
CAKCAFH4119.9°120.1°
CAFCADCAC120.3°120.2°
CAFCADH2119.9°119.9°
CADCAFH4120.0°120.1°
CAKCAGCAE120.1°119.8°
CAKCAGH5119.9°120.1°
CADCACCAE120.0°120.2°
CADCACH1120.0°119.9°
CACCADH2119.9°119.9°
CAGCAECAC119.7°120.2°
CAGCAEH3120.2°120.0°
CAECAGH5120.0°120.1°
CAECACH1120.0°119.9°
CACCAEH3120.2°119.8°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
OABCANNAJNAI179.3°179.7°
OABCANNAJCAM179.8°180.0°
OABCANNAICAL179.8°180.0°
OABCANNAJH80.2°0.3°
OABCANNAIH70.2°0.3°
CANNAJCAMH8180.0°179.7°
NAJCANNAICAL0.9°0.3°
CANNAJCAMOAA179.9°180.0°
CANNAJCAMCAH0.7°0.0°
NAJCANNAIH7179.1°180.0°
NAICANNAJCAM0.9°0.3°
CANNAICALH7180.0°179.7°
CANNAICALCAH0.9°0.0°
CANNAICALCAK179.1°180.0°
NAICANNAJH8179.1°180.0°
NAJCAMOAACAH179.3°180.0°
NAJCAMCAHCAL0.7°0.3°
NAJCAMCAHH6179.3°180.0°
NAICALCAHCAM0.7°0.3°
NAICALCAHCAK180.0°180.0°
NAICALCAKCAF33.4°0.0°
NAICALCAKCAG147.6°179.8°
NAICALCAHH6179.2°180.0°
OAACAMCAHCAL180.0°179.7°
OAACAMCAHH60.0°0.0°
OAACAMNAJH80.1°0.3°
CAMCAHCALH6180.0°179.7°
CAMCAHCALCAK179.2°179.7°
CAHCAMNAJH8179.3°179.7°
CAHCALCAKCAF146.6°180.0°
CAHCALCAKCAG32.4°0.3°
CAHCALNAIH7179.1°179.7°
CALCAKCAFCAG179.0°179.7°
CALCAKCAFCAD179.5°180.0°
CALCAKCAGCAE179.7°179.8°
CALCAKCAFH40.5°0.3°
CALCAKCAGH50.3°0.3°
CAKCALCAHH60.8°0.1°
CAKCALNAIH70.9°0.3°
CAKCAFCADH4180.0°179.7°
CAKCAFCADCAC0.1°0.0°
CAFCAKCAGCAE0.7°0.5°
CAKCAFCADH2179.9°180.0°
CAFCAKCAGH5179.3°180.0°
CADCAFCAKCAG0.5°0.2°
CAFCADCACH2180.0°180.0°
CAFCADCACCAE0.2°0.0°
CAFCADCACH1179.8°179.7°
CAKCAGCAEH5180.0°179.6°
CAKCAGCAECAC0.4°0.5°
CAKCAGCAEH3179.6°179.5°
CAGCAKCAFH4179.5°180.0°
CADCACCAECAG0.0°0.2°
CADCACCAEH1180.0°179.7°
CADCACCAEH3180.0°179.8°
CACCADCAFH4179.9°179.7°
CAGCAECACH3180.0°180.0°
CAGCAECACH1180.0°180.0°
CAECACCADH2179.8°180.0°
CACCAECAGH5179.6°180.0°
H1CACCADH20.2°0.2°
H1CACCAEH30.0°0.0°
H2CADCAFH40.1°0.2°
H3CAECAGH50.4°0.0°

238582

PDB entries from 2025-07-09

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