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0Y1

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
NCAsing1.47Å1.45Å
CACsing1.51Å1.51Å
CACBsing1.53Å1.50Å
OXTCdoub1.21Å1.28Å
COsing1.34Å1.27Å
CBCASsing1.53Å1.52Å
CASNARsing1.47Å1.51Å
CBFNBEsing1.37Å1.41ÅAromatic
CBFCBBdoub1.34Å1.36ÅAromatic
NBECBDsing1.38Å1.40ÅAromatic
NARCAZsing1.47Å1.49Å
NARCAFsing1.47Å1.49Å
CAZCBAsing1.53Å1.52Å
CBBCBAsing1.51Å1.52Å
CBBCBCsing1.47Å1.34ÅAromatic
CBDCBJdoub1.39Å1.39ÅAromatic
CBDCBCsing1.41Å1.36ÅAromatic
CAFCAAsing1.53Å1.47Å
CBJCBIsing1.38Å1.37ÅAromatic
CBCCBGdoub1.40Å1.40ÅAromatic
CAAOAEsing1.44Å1.46Å
CAACABsing1.54Å1.49Å
CBICBHdoub1.39Å1.39ÅAromatic
OAECADsing1.44Å1.42Å
CBGCBHsing1.37Å1.39ÅAromatic
OAHCABsing1.43Å1.39Å
CABCACsing1.55Å1.47Å
CADCACsing1.55Å1.50Å
CADN9sing1.46Å1.49Å
CACOAIsing1.43Å1.39Å
N3C4doub1.33Å1.35ÅAromatic
N3C2sing1.32Å1.34ÅAromatic
N9C4sing1.37Å1.36ÅAromatic
N9C8sing1.36Å1.35ÅAromatic
C4C5sing1.40Å1.41ÅAromatic
C2N1doub1.32Å1.35ÅAromatic
C8N7doub1.30Å1.35ÅAromatic
C5N7sing1.35Å1.36ÅAromatic
C5C6doub1.41Å1.40ÅAromatic
N1C6sing1.33Å1.35ÅAromatic
C6N6sing1.38Å1.46Å
CBGH1sing1.08Å1.08Å
CBHH2sing1.08Å1.08Å
CBIH3sing1.08Å1.08Å
CBJH4sing1.08Å1.08Å
NBEH5sing0.97Å1.00Å
CBFH6sing1.08Å1.08Å
CBAH7sing1.09Å1.10Å
CBAH8sing1.09Å1.10Å
CAZH9sing1.09Å1.10Å
CAZH10sing1.09Å1.10Å
CASH12sing1.09Å1.10Å
CASH13sing1.09Å1.10Å
CBH14sing1.09Å1.10Å
CBH15sing1.09Å1.10Å
CAH16sing1.09Å1.10Å
OH17sing0.97Å0.95Å
NH18sing1.01Å1.00Å
NH19sing1.01Å1.00Å
CAFH21sing1.09Å1.10Å
CAFH22sing1.09Å1.10Å
CAAH23sing1.09Å1.10Å
CABH24sing1.09Å1.10Å
OAHH25sing0.97Å0.95Å
CACH26sing1.09Å1.10Å
OAIH27sing0.97Å0.95Å
CADH28sing1.09Å1.10Å
C8H29sing1.08Å1.08Å
C2H30sing1.08Å1.08Å
N6H31sing0.97Å1.00Å
N6H32sing0.97Å1.00Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
NCAC108.9°109.5°
NCACB110.6°109.5°
NCAH16108.9°109.5°
CANH18109.5°111.0°
CANH19109.5°111.0°
CCACB111.8°109.5°
CACOXT120.3°119.9°
CACO121.1°120.0°
CCAH16108.2°109.4°
CACBCAS121.3°109.5°
CACBH14106.4°109.5°
CACBH15106.4°109.5°
CBCAH16108.3°109.5°
OXTCO118.6°120.1°
COH17109.5°116.9°
CBCASNAR119.5°109.5°
CBCASH12106.9°109.5°
CBCASH13106.9°109.5°
CASCBH14106.4°109.5°
CASCBH15106.4°109.5°
CASNARCAZ111.6°111.0°
CASNARCAF116.7°111.0°
NARCASH12106.9°109.5°
NARCASH13106.9°109.4°
NBECBFCBB107.5°109.9°
CBFNBECBD104.9°109.9°
CBFNBEH5127.6°125.1°
NBECBFH6126.3°125.0°
CBFCBBCBA123.8°126.5°
CBFCBBCBC110.3°107.0°
CBBCBFH6126.2°125.1°
NBECBDCBJ128.7°133.5°
NBECBDCBC109.0°107.1°
CBDNBEH5127.6°125.0°
CAZNARCAF115.0°111.0°
NARCAZCBA116.7°109.5°
NARCAZH9107.6°109.5°
NARCAZH10107.6°109.5°
NARCAFCAA117.7°109.5°
NARCAFH21107.4°109.5°
NARCAFH22107.3°109.5°
CAZCBACBB125.6°109.5°
CAZCBAH7105.3°109.5°
CAZCBAH8105.3°109.5°
CBACAZH9107.7°109.5°
CBACAZH10107.6°109.4°
CBACBBCBC126.0°126.5°
CBBCBAH7105.3°109.4°
CBBCBAH8105.3°109.5°
CBBCBCCBD108.3°106.0°
CBBCBCCBG133.0°134.0°
CBJCBDCBC122.3°119.3°
CBDCBJCBI119.0°119.8°
CBDCBJH4120.5°120.1°
CBDCBCCBG118.7°119.9°
CAFCAAOAE111.7°109.9°
CAFCAACAB115.2°109.9°
CAACAFH21107.4°109.5°
CAACAFH22107.4°109.4°
CAFCAAH23108.4°109.9°
CBJCBICBH120.2°120.7°
CBJCBIH3119.9°119.7°
CBICBJH4120.5°120.1°
CBCCBGCBH119.4°119.8°
CBCCBGH1120.3°120.1°
OAECAACAB104.6°107.3°
CAAOAECAD108.2°107.0°
OAECAAH23108.6°109.8°
CAACABOAH109.9°110.5°
CAACABCAC105.5°104.2°
CABCAAH23108.1°110.0°
CAACABH24110.3°110.5°
CBICBHCBG120.3°120.5°
CBICBHH2119.8°119.8°
CBHCBIH3119.9°119.6°
OAECADCAC103.3°103.5°
OAECADN9111.1°110.7°
OAECADH28109.0°110.6°
CBHCBGH1120.3°120.1°
CBGCBHH2119.8°119.7°
OAHCABCAC108.5°110.5°
OAHCABH24111.9°110.5°
CABOAHH25109.5°114.0°
CABCACCAD100.9°102.1°
CABCACOAI112.8°110.9°
CACCABH24110.6°110.4°
CABCACH26109.3°111.0°
CACCADN9117.0°110.6°
CADCACOAI113.7°110.9°
CADCACH26109.0°110.9°
CACCADH28108.0°110.6°
CADN9C4123.1°126.3°
CADN9C8128.2°126.3°
N9CADH28108.1°110.7°
OAICACH26110.6°110.7°
CACOAIH27109.5°114.0°
C4N3C2122.7°120.7°
N3C4N9134.9°134.9°
N3C4C5118.9°119.1°
N3C2N1119.4°122.4°
N3C2H30120.3°118.8°
C4N9C8108.7°107.4°
N9C4C5106.2°106.0°
N9C8N7109.3°110.0°
N9C8H29125.4°125.0°
C4C5N7107.9°107.2°
C4C5C6117.5°118.2°
C2N1C6121.3°121.2°
N1C2H30120.3°118.8°
C8N7C5107.9°109.4°
N7C8H29125.3°125.0°
N7C5C6134.6°134.7°
C5C6N1120.2°118.4°
C5C6N6119.1°120.7°
N1C6N6120.7°120.8°
C6N6H31109.5°120.0°
C6N6H32109.5°120.0°
H7CBAH8109.4°109.4°
H9CAZH10109.5°109.4°
H12CASH13109.5°109.4°
H14CBH15109.5°109.5°
H18NH19109.5°111.0°
H21CAFH22109.5°109.4°
H31N6H32109.5°119.9°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
NCACCB122.5°120.0°
NCACH16118.3°120.0°
NCACBH16119.3°120.0°
NCACOXT128.0°20.9°
NCACO53.7°159.1°
NCACBCAS117.9°65.7°
NCACBH143.8°174.4°
NCACBH15120.5°54.3°
CANH18H19120.0°123.9°
CCACBH16119.1°119.9°
CACOXTO178.4°180.0°
CCACBCAS120.6°174.3°
CCACBH14117.8°54.3°
CCACBH151.1°65.7°
CACOH17178.3°180.0°
CCANH18180.0°63.9°
CCANH1960.0°60.0°
CBCACOXT109.5°99.1°
CBCACO68.8°80.9°
CACBCASH14121.6°120.0°
CACBCASH15121.6°120.0°
CACBCASNAR122.7°176.6°
CACBCASH121.3°63.4°
CACBCASH13115.8°56.6°
CACBH14H15114.6°120.0°
CBCANH1856.8°176.1°
CBCANH19176.8°60.0°
OXTCCAH169.7°140.9°
OXTCOH170.0°0.0°
OCCAH16172.0°39.1°
CBCASNARH12121.4°120.0°
CBCASNARH13121.4°120.0°
CBCASNARCAZ84.1°163.8°
CBCASNARCAF51.0°72.2°
CBCASH12H13115.5°120.0°
CASCBH14H15114.7°120.0°
CASCBCAH161.4°54.3°
CASNARCAZCAF135.9°124.0°
CASNARCAZCBA160.5°66.0°
CASNARCAFCAA124.6°159.9°
CASNARCAZH978.4°54.0°
CASNARCAZH1039.4°174.0°
NARCASH12H13115.5°119.9°
NARCASCBH14115.6°56.6°
NARCASCBH151.1°63.4°
CASNARCAFH213.5°39.8°
CASNARCAFH22114.2°80.2°
NBECBFCBBH6180.0°179.8°
CBFNBECBDH5180.0°180.0°
NBECBFCBBCBA179.8°179.9°
NBECBFCBBCBC0.4°0.4°
CBFNBECBDCBJ178.8°180.0°
CBFNBECBDCBC1.0°0.0°
CBBCBFNBECBD0.9°0.2°
CBFCBBCBACAZ8.4°95.0°
CBFCBBCBACBC179.2°179.5°
CBFCBBCBCCBD0.2°0.4°
CBFCBBCBCCBG179.2°179.9°
CBBCBFNBEH5179.1°179.8°
CBFCBBCBAH7130.6°25.0°
CBFCBBCBAH8113.7°145.0°
NBECBDCBCCBB0.8°0.2°
NBECBDCBJCBC179.9°180.0°
NBECBDCBJCBI179.7°180.0°
NBECBDCBCCBG179.9°180.0°
NBECBDCBJH40.3°0.0°
CBDNBECBFH6179.1°180.0°
NARCAZCBAH9121.1°120.1°
NARCAZCBAH10121.0°120.0°
NARCAZCBACBB123.9°180.0°
CAZNARCAFCAA101.8°76.2°
NARCAZCBAH71.7°60.0°
NARCAZCBAH8114.0°60.0°
NARCAZH9H10116.7°120.0°
CAZNARCASH1237.3°43.8°
CAZNARCASH13154.5°76.1°
CAZNARCAFH21137.0°163.8°
CAZNARCAFH2219.4°43.8°
CAFNARCAZCBA63.7°170.0°
NARCAFCAAH21121.2°120.1°
NARCAFCAAH22121.2°120.0°
NARCAFCAAOAE148.6°62.5°
NARCAFCAACAB92.3°179.6°
CAFNARCAZH957.4°69.9°
CAFNARCAZH10175.3°50.0°
CAFNARCASH12172.4°167.8°
CAFNARCASH1370.4°47.9°
NARCAFH21H22116.2°120.0°
NARCAFCAAH2329.0°58.5°
CAZCBACBBH7122.2°120.0°
CAZCBACBBH8122.2°120.1°
CAZCBACBBCBC172.3°84.5°
CAZCBAH7H8112.8°120.0°
CBACAZH9H10116.7°120.0°
CBACBBCBCCBD179.1°180.0°
CBACBBCBCCBG0.1°0.3°
CBACBBCBFH60.2°0.3°
CBBCBAH7H8112.8°119.9°
CBBCBACAZH9115.1°60.0°
CBBCBACAZH102.8°60.0°
CBBCBCCBDCBJ179.1°179.8°
CBBCBCCBDCBG179.1°179.8°
CBBCBCCBGCBH178.9°179.7°
CBBCBCCBGH11.1°0.4°
CBCCBBCBFH6179.6°179.8°
CBCCBBCBAH750.2°155.5°
CBCCBBCBAH865.5°35.5°
CBDCBJCBIH4180.0°179.9°
CBJCBDCBCCBG0.0°0.0°
CBDCBJCBICBH0.4°0.0°
CBDCBJCBIH3179.6°179.9°
CBJCBDNBEH51.1°0.0°
CBCCBDCBJCBI0.1°0.0°
CBDCBCCBGCBH0.0°0.0°
CBDCBCCBGH1180.0°179.9°
CBCCBDCBJH4179.9°180.0°
CBCCBDNBEH5179.0°180.0°
CAFCAAOAECAB125.3°119.5°
CAFCAAOAEH23119.5°121.0°
CAFCAACABH23121.4°121.1°
CAFCAAOAECAD135.8°145.9°
CAFCAACABOAH136.7°119.9°
CAFCAACABCAC106.6°121.4°
CAACAFH21H22116.3°119.9°
CAFCAACABH2412.9°2.8°
CBJCBICBHH3180.0°180.0°
CBJCBICBHCBG0.5°0.0°
CBJCBICBHH2179.5°179.9°
CBCCBGCBHCBI0.3°0.0°
CBCCBGCBHH1180.0°180.0°
CBCCBGCBHH2179.7°179.9°
OAECAACABH23115.6°119.5°
OAECAACABOAH100.3°120.7°
OAECAACABCAC16.4°2.0°
CAAOAECADCAC32.8°40.0°
CAAOAECADN9159.1°158.5°
OAECAACAFH2127.4°57.6°
OAECAACAFH2290.3°177.5°
OAECAACABH24135.9°116.6°
CAAOAECADH2881.8°78.5°
CABCAAOAECAD10.5°26.5°
CAACABOAHCAC114.9°114.8°
CAACABOAHH24122.9°122.7°
CAACABCACH24119.3°118.7°
CAACABCACCAD35.3°20.9°
CAACABCACOAI157.0°139.1°
CABCAACAFH21146.5°60.3°
CABCAACAFH2228.8°59.7°
CAACABOAHH25180.0°180.0°
CAACABCACH2679.5°97.4°
CBICBHCBGH2180.0°179.9°
CBICBHCBGH1179.7°179.9°
CBHCBICBJH4179.6°180.0°
OAECADCACCAB41.6°37.0°
OAECADCACN9122.4°118.6°
OAECADCACH28115.4°118.5°
OAECADN9H28119.6°122.9°
OAECADCACOAI162.7°155.2°
OAECADN9C496.8°156.4°
OAECADN9C880.6°23.8°
CADOAECAAH23104.8°93.1°
OAECADCACH2673.4°81.3°
CBGCBHCBIH3179.5°180.0°
OAHCABCACH24123.1°122.6°
OAHCABCACCAD82.4°97.8°
OAHCABCACOAI39.3°20.4°
OAHCABCAAH2315.3°1.2°
OAHCABCACH26162.8°143.9°
CABCACCADOAI121.1°118.2°
CABCACCADH26115.0°118.3°
CABCACCADN9164.1°155.6°
CABCACOAIH26122.8°123.6°
CACCABCAAH23132.0°117.5°
CACCABOAHH2565.1°65.2°
CABCACOAIH27180.0°61.4°
CABCACCADH2873.8°81.5°
CACCADN9H28122.1°123.0°
CADCACOAIH26123.1°123.6°
CACCADN9C4144.9°89.5°
CACCADN9C837.6°90.3°
CADCACCABH24154.5°139.6°
CADCACOAIH2765.9°174.1°
N9CADCACOAI74.8°86.2°
CADN9C4N31.9°0.0°
CADN9C4C8177.9°179.8°
CADN9C4C5178.4°179.9°
CADN9C8N7178.5°179.9°
N9CADCACH2649.1°37.3°
CADN9C8H291.5°0.1°
OAICACCABH2483.7°102.2°
OAICACCADH2847.3°36.7°
N3C4N9C5179.7°179.9°
N3C4N9C8179.8°179.8°
C4N3C2N10.6°0.1°
N3C4C5N7179.8°179.7°
N3C4C5C60.2°0.1°
C4N3C2H30179.4°180.0°
C2N3C4N9180.0°180.0°
C2N3C4C50.3°0.1°
N3C2N1H30180.0°179.9°
N3C2N1C60.3°0.5°
C4N9C8N70.7°0.2°
N9C4C5N70.1°0.4°
N9C4C5C6179.6°179.8°
C4N9CADH2822.8°33.5°
C4N9C8H29179.3°179.7°
C8N9C4C50.5°0.3°
N9C8N7H29180.0°179.9°
N9C8N7C50.7°0.1°
C8N9CADH28159.7°146.8°
C4C5N7C80.3°0.3°
C4C5N7C6179.6°179.8°
C4C5C6N10.4°0.5°
C4C5C6N6179.3°179.8°
C2N1C6C50.2°0.7°
C2N1C6N6179.1°180.0°
C8N7C5C6179.9°179.9°
N7C5C6N1180.0°179.2°
N7C5C6N61.1°0.0°
C5N7C8H29179.3°180.0°
C5C6N1N6178.9°179.3°
C5C6N6H31178.9°0.0°
C5C6N6H3258.9°180.0°
C6N1C2H30179.7°179.6°
N1C6N6H310.0°179.2°
N1C6N6H32120.0°0.7°
C6N6H31H32120.0°179.9°
H1CBGCBHH20.3°0.0°
H2CBHCBIH30.5°0.1°
H3CBICBJH40.4°0.0°
H5NBECBFH60.8°0.0°
H7CBACAZH9122.7°179.9°
H7CBACAZH10119.3°60.0°
H8CBACAZH97.1°60.1°
H8CBACAZH10125.0°180.0°
H12CASCBH14123.0°176.6°
H12CASCBH15120.3°56.6°
H13CASCBH145.8°63.4°
H13CASCBH15122.5°176.6°
H14CBCAH16123.1°65.6°
H15CBCAH16120.2°174.3°
H16CANH1862.2°56.1°
H16CANH1957.9°180.0°
H21CAFCAAH2392.2°178.6°
H22CAFCAAH23150.1°61.5°
H23CAACABH24108.5°123.9°
H24CABOAHH2557.1°57.3°
H24CABCACH2639.7°21.3°
H26CACOAIH2757.2°62.2°
H26CACCADH28171.2°160.3°

227344

PDB entries from 2024-11-13

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