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3KN

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
SAACABsing1.76Å1.78ÅAromatic
SAACAEsing1.77Å1.74ÅAromatic
CAJNAKdoub1.32Å1.42ÅAromatic
CAJCAGsing1.39Å1.39ÅAromatic
NAKCALsing1.32Å1.42ÅAromatic
NAFCABsing1.39Å1.34Å
CABNACdoub1.30Å1.34ÅAromatic
CAECAGsing1.48Å1.34Å
CAENADdoub1.30Å1.34ÅAromatic
CAGCAIdoub1.41Å1.40ÅAromatic
CALCAHdoub1.38Å1.39ÅAromatic
NACNADsing1.26Å1.38ÅAromatic
CAICAHsing1.39Å1.40ÅAromatic
CAINAMsing1.39Å1.31Å
NAMH1sing0.97Å1.00Å
NAMH2sing0.97Å1.00Å
CAHH3sing1.08Å1.08Å
CALH4sing1.08Å1.08Å
CAJH5sing1.08Å1.08Å
NAFH6sing0.97Å1.00Å
NAFH7sing0.97Å1.00Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
CABSAACAE92.0°88.9°
SAACABNAF127.0°126.0°
SAACABNAC108.7°107.8°
SAACAECAG128.0°126.1°
SAACAENAD108.7°107.8°
NAKCAJCAG117.7°120.6°
CAJNAKCAL122.8°122.1°
NAKCAJH5121.1°119.6°
CAJCAGCAE121.2°120.6°
CAJCAGCAI118.6°118.8°
CAGCAJH5121.1°119.7°
NAKCALCAH118.8°121.1°
NAKCALH4120.6°119.4°
NAFCABNAC124.3°126.1°
CABNAFH6109.5°120.1°
CABNAFH7109.5°120.0°
CABNACNAD114.3°117.7°
CAGCAENAD123.2°126.1°
CAECAGCAI120.0°120.6°
CAENADNAC116.3°117.7°
CAGCAICAH124.3°118.1°
CAGCAINAM115.6°120.9°
CALCAHCAI117.7°119.2°
CALCAHH3121.1°120.4°
CAHCALH4120.6°119.4°
CAHCAINAM120.1°120.9°
CAICAHH3121.2°120.4°
CAINAMH1109.5°120.0°
CAINAMH2109.5°120.0°
H1NAMH2109.5°120.0°
H6NAFH7109.4°120.0°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
SAACABNAFNAC179.7°179.8°
CABSAACAECAG176.6°180.0°
CABSAACAENAD0.4°0.2°
SAACABNACNAD0.3°0.1°
SAACABNAFH60.0°0.1°
SAACABNAFH7120.0°180.0°
SAACAECAGCAJ1.5°0.3°
CAESAACABNAF179.7°180.0°
CAESAACABNAC0.0°0.2°
SAACAECAGNAD175.7°179.7°
SAACAECAGCAI176.9°179.7°
SAACAENADNAC0.6°0.2°
NAKCAJCAGH5180.0°179.7°
NAKCAJCAGCAE177.2°180.0°
NAKCAJCAGCAI1.7°0.6°
CAJNAKCALCAH0.1°0.1°
CAJNAKCALH4179.9°180.0°
CAGCAJNAKCAL0.5°0.2°
CAJCAGCAECAI175.4°179.4°
CAJCAGCAENAD174.2°180.0°
CAJCAGCAICAH2.6°0.5°
CAJCAGCAINAM178.7°179.7°
NAKCALCAHH4180.0°179.9°
NAKCALCAHCAI0.6°0.1°
NAKCALCAHH3179.4°179.9°
CALNAKCAJH5179.5°180.0°
NAFCABNACNAD179.9°179.9°
CABNAFH6H7120.0°179.9°
CABNACNADCAE0.6°0.1°
NACCABNAFH6179.7°179.9°
NACCABNAFH759.7°0.2°
CAGCAENADNAC177.1°180.0°
CAECAGCAICAH178.1°180.0°
CAECAGCAINAM3.2°0.2°
CAECAGCAJH52.8°0.3°
NADCAECAGCAI1.2°0.6°
CAGCAICAHCAL1.9°0.2°
CAGCAICAHNAM178.7°179.8°
CAGCAINAMH1180.0°179.7°
CAGCAINAMH260.0°0.5°
CAGCAICAHH3178.1°179.8°
CAICAGCAJH5178.2°179.7°
CALCAHCAIH3180.0°180.0°
CALCAHCAINAM179.4°180.0°
CAHCAINAMH11.2°0.1°
CAHCAINAMH2121.3°179.7°
CAICAHCALH4179.5°180.0°
CAINAMH1H2120.0°179.8°
NAMCAICAHH30.6°0.0°
H3CAHCALH40.5°0.0°

227344

PDB entries from 2024-11-13

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