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Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
CACCABdoub1.38Å1.41ÅAromatic
CACCAIsing1.39Å1.39ÅAromatic
CABCADsing1.38Å1.40ÅAromatic
NAACAIsing1.40Å1.38Å
CAICAKdoub1.39Å1.41ÅAromatic
CADCAJdoub1.39Å1.41ÅAromatic
CAKCAJsing1.38Å1.42ÅAromatic
CAKCAFsing1.51Å1.44Å
CAJCAGsing1.51Å1.44Å
CAFCAEsing1.53Å1.53Å
CAGNAHsing1.47Å1.50Å
CAENAHsing1.47Å1.47Å
CAGH1sing1.09Å1.10Å
CAGH2sing1.09Å1.10Å
NAHH3sing1.01Å1.00Å
CAEH5sing1.09Å1.10Å
CAEH6sing1.09Å1.10Å
CAFH7sing1.09Å1.10Å
CAFH8sing1.09Å1.10Å
CADH9sing1.08Å1.08Å
CABH10sing1.08Å1.08Å
CACH11sing1.08Å1.08Å
NAAH12sing0.97Å1.00Å
NAAH13sing0.97Å1.00Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
CABCACCAI117.5°119.8°
CACCABCAD120.4°120.0°
CACCABH10119.8°120.0°
CABCACH11121.2°120.1°
CACCAINAA119.4°119.9°
CACCAICAK122.7°120.2°
CAICACH11121.2°120.1°
CABCADCAJ121.9°120.5°
CABCADH9119.0°119.8°
CADCABH10119.8°120.0°
NAACAICAK118.0°119.9°
CAINAAH12109.5°120.0°
CAINAAH13109.5°120.0°
CAICAKCAJ119.8°119.8°
CAICAKCAF119.4°118.5°
CADCAJCAK117.6°119.8°
CADCAJCAG120.6°118.4°
CAJCADH9119.0°119.7°
CAJCAKCAF120.8°121.7°
CAKCAJCAG121.8°121.8°
CAKCAFCAE112.0°109.9°
CAKCAFH7108.8°109.3°
CAKCAFH8108.9°109.3°
CAJCAGNAH114.9°110.5°
CAJCAGH1108.1°109.3°
CAJCAGH2108.1°109.1°
CAFCAENAH110.4°108.5°
CAFCAEH5109.2°109.7°
CAFCAEH6109.2°109.8°
CAECAFH7108.8°109.4°
CAECAFH8108.8°109.4°
CAGNAHCAE109.3°110.2°
NAHCAGH1108.1°109.3°
NAHCAGH2108.1°109.3°
CAGNAHH3109.5°111.0°
CAENAHH3109.5°111.0°
NAHCAEH5109.2°109.6°
NAHCAEH6109.2°109.6°
H1CAGH2109.5°109.3°
H5CAEH6109.5°109.6°
H7CAFH8109.5°109.4°
H12NAAH13109.5°120.0°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
CABCACCAIH11180.0°180.0°
CACCABCADH10180.0°179.9°
CABCACCAINAA179.4°179.9°
CABCACCAICAK0.8°0.1°
CACCABCADCAJ1.0°0.0°
CACCABCADH9179.0°180.0°
CAICACCABCAD1.7°0.0°
CACCAINAACAK179.8°180.0°
CACCAICAKCAJ0.8°0.2°
CACCAICAKCAF178.2°179.7°
CAICACCABH10178.3°179.9°
CACCAINAAH12180.0°0.1°
CACCAINAAH1360.0°180.0°
CABCADCAJH9180.0°180.0°
CABCADCAJCAK0.6°0.1°
CABCADCAJCAG179.2°179.8°
CADCABCACH11178.3°180.0°
NAACAICAKCAJ179.0°179.8°
NAACAICAKCAF1.6°0.4°
NAACAICACH110.6°0.0°
CAINAAH12H13120.0°179.9°
CAICAKCAJCAD1.5°0.2°
CAICAKCAJCAF177.3°179.8°
CAICAKCAJCAG179.9°179.8°
CAICAKCAFCAE161.9°163.4°
CAICAKCAFH777.7°43.3°
CAICAKCAFH841.5°76.5°
CAKCAICACH11179.2°180.0°
CAKCAINAAH120.2°179.9°
CAKCAINAAH13119.8°0.0°
CADCAJCAKCAG178.6°180.0°
CADCAJCAKCAF178.8°179.6°
CADCAJCAGNAH167.1°162.4°
CADCAJCAGH172.1°42.1°
CADCAJCAGH246.4°77.4°
CAJCADCABH10179.0°179.9°
CAJCAKCAFCAE20.8°16.8°
CAKCAJCAGNAH14.3°17.6°
CAKCAJCAGH1106.5°137.9°
CAKCAJCAGH2135.1°102.6°
CAJCAKCAFH799.6°136.9°
CAJCAKCAFH8141.2°103.3°
CAKCAJCADH9179.3°179.9°
CAFCAKCAJCAG2.6°0.4°
CAKCAFCAEH7120.4°120.1°
CAKCAFCAEH8120.4°120.1°
CAKCAFCAENAH51.5°50.3°
CAKCAFCAEH5171.6°69.4°
CAKCAFCAEH668.7°170.1°
CAKCAFH7H8118.9°119.7°
CAJCAGNAHH1120.8°120.3°
CAJCAGNAHH2120.8°120.1°
CAJCAGNAHCAE44.3°52.6°
CAJCAGH1H2117.5°119.4°
CAJCAGNAHH3164.3°176.0°
CAGCAJCADH90.7°0.1°
CAFCAENAHCAG63.2°71.3°
CAFCAENAHH5120.1°119.7°
CAFCAENAHH6120.2°119.9°
CAFCAENAHH3176.8°165.3°
CAFCAEH5H6119.5°120.6°
CAECAFH7H8118.8°119.8°
CAGNAHCAEH3120.0°123.4°
NAHCAGH1H2117.6°119.6°
CAGNAHCAEH5176.7°48.5°
CAGNAHCAEH656.9°168.9°
CAENAHCAGH176.4°172.9°
CAENAHCAGH2165.1°67.5°
NAHCAEH5H6119.6°120.4°
NAHCAECAFH768.9°170.4°
NAHCAECAFH8171.9°69.7°
H1CAGNAHH343.6°63.7°
H2CAGNAHH374.9°55.8°
H3NAHCAEH556.7°74.9°
H3NAHCAEH663.0°45.5°
H5CAECAFH751.3°50.7°
H5CAECAFH868.0°170.6°
H6CAECAFH7171.0°69.8°
H6CAECAFH851.7°50.0°
H9CADCABH101.0°0.1°
H10CABCACH111.7°0.1°

223532

PDB entries from 2024-08-07

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