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D2N

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C2N1doub1.33Å1.34ÅAromatic
N1C6sing1.33Å1.34ÅAromatic
N3C2sing1.32Å1.34ÅAromatic
NADC2sing1.38Å1.35Å
N3C4doub1.34Å1.34ÅAromatic
NARC4sing1.33Å1.35ÅAromatic
C4C5sing1.42Å1.39ÅAromatic
C5CBBsing1.40Å1.41ÅAromatic
C5C6doub1.42Å1.42ÅAromatic
C6NAEsing1.38Å1.34Å
CAACAKsing1.53Å1.54Å
CAAHAAsing1.09Å1.10Å
CAAHAAAsing1.09Å1.10Å
CAAHAABsing1.09Å1.10Å
OAUCABsing1.43Å1.43Å
CABHABsing1.09Å1.10Å
CABHABAsing1.09Å1.10Å
CABHABBsing1.09Å1.10Å
CBBCACsing1.51Å1.55Å
CACHACsing1.09Å1.10Å
CACHACAsing1.09Å1.10Å
CACHACBsing1.09Å1.10Å
NADHNADsing0.97Å1.00Å
NADHNAAsing0.97Å1.00Å
NAEHNAEsing0.97Å1.00Å
NAEHNABsing0.97Å1.00Å
OAFCAXdoub1.21Å1.23Å
CAHCAGdoub1.38Å1.39ÅAromatic
CAGCAZsing1.39Å1.38ÅAromatic
CAGHAGsing1.08Å1.08Å
CAHCBEsing1.39Å1.39ÅAromatic
CAHHAHsing1.08Å1.08Å
NARCAIdoub1.31Å1.33ÅAromatic
CAICBCsing1.39Å1.39ÅAromatic
CAIHAIsing1.08Å1.08Å
CAZCAJdoub1.39Å1.41ÅAromatic
CBDCAJsing1.38Å1.40ÅAromatic
CAJHAJsing1.08Å1.08Å
OAVCAKsing1.45Å1.45Å
CAKHAKsing1.09Å1.10Å
CAKHAKAsing1.09Å1.10Å
CAMCALsing1.53Å1.53Å
CANCALsing1.53Å1.53Å
CALHALsing1.09Å1.10Å
CALHALAsing1.09Å1.10Å
CAMCAOsing1.53Å1.52Å
CAMHAMsing1.09Å1.10Å
CAMHAMAsing1.09Å1.10Å
CAPCANsing1.53Å1.53Å
CANHANsing1.09Å1.10Å
CANHANAsing1.09Å1.10Å
CAOOAWsing1.43Å1.44Å
CAOHAOsing1.09Å1.10Å
CAOHAOAsing1.09Å1.10Å
CAPCAXsing1.51Å1.53Å
CAPHAPsing1.09Å1.10Å
CAPHAPAsing1.09Å1.10Å
CBDCAQsing1.51Å1.56Å
CBCCAQsing1.51Å1.56Å
CAQHAQsing1.09Å1.10Å
CAQHAQAsing1.09Å1.10Å
OAUCBEsing1.36Å1.35Å
CAXOAVsing1.34Å1.37Å
CAZOAWsing1.36Å1.37Å
CBCCBBdoub1.37Å1.40ÅAromatic
CBECBDdoub1.39Å1.40ÅAromatic
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C2N1C6121.0°121.2°
N1C2N3120.7°122.9°
N1C2NAD121.6°118.5°
N1C6C5120.3°118.3°
N1C6NAE114.4°120.8°
N3C2NAD117.6°118.5°
C2N3C4120.3°120.5°
C2NADHNAD109.5°120.0°
C2NADHNAA109.4°120.0°
N3C4NAR115.4°121.6°
N3C4C5121.7°118.6°
NARC4C5122.9°119.8°
C4NARCAI119.4°121.2°
C4C5CBB117.8°119.3°
C4C5C6115.8°118.6°
CBBC5C6126.3°122.1°
C5CBBCAC124.5°121.0°
C5CBBCBC118.8°118.0°
C5C6NAE125.3°120.9°
C6NAEHNAE109.5°120.0°
C6NAEHNAB109.5°120.0°
CAKCAAHAA109.5°109.5°
CAKCAAHAAA109.5°109.5°
CAKCAAHAAB109.4°109.5°
CAACAKOAV113.6°109.5°
CAACAKHAK108.1°109.5°
CAACAKHAKA108.1°109.5°
HAACAAHAAA109.5°109.5°
HAACAAHAAB109.5°109.5°
HAAACAAHAAB109.5°109.4°
OAUCABHAB109.5°109.5°
OAUCABHABA109.4°109.5°
OAUCABHABB109.5°109.5°
CABOAUCBE104.1°117.0°
HABCABHABA109.4°109.4°
HABCABHABB109.5°109.5°
HABACABHABB109.5°109.5°
CBBCACHAC109.5°109.5°
CBBCACHACA109.5°109.5°
CBBCACHACB109.5°109.4°
CACCBBCBC116.7°121.0°
HACCACHACA109.4°109.5°
HACCACHACB109.4°109.5°
HACACACHACB109.5°109.5°
HNADNADHNAA109.5°120.0°
HNAENAEHNAB109.5°120.0°
OAFCAXCAP119.8°120.0°
OAFCAXOAV118.4°120.0°
CAHCAGCAZ120.3°120.0°
CAHCAGHAG119.8°120.0°
CAGCAHCBE119.3°120.1°
CAGCAHHAH120.4°119.9°
CAZCAGHAG119.8°120.0°
CAGCAZCAJ120.5°120.0°
CAGCAZOAW116.5°120.0°
CBECAHHAH120.3°120.0°
CAHCBEOAU118.2°120.1°
CAHCBECBD121.8°120.0°
NARCAICBC121.7°121.8°
NARCAIHAI119.2°119.1°
CBCCAIHAI119.1°119.1°
CAICBCCAQ119.0°120.1°
CAICBCCBB119.3°119.9°
CAZCAJCBD119.6°120.0°
CAZCAJHAJ120.2°120.0°
CAJCAZOAW123.0°120.0°
CBDCAJHAJ120.2°120.0°
CAJCBDCAQ119.7°120.0°
CAJCBDCBE118.5°120.0°
OAVCAKHAK108.1°109.5°
OAVCAKHAKA108.1°109.4°
CAKOAVCAX107.7°117.0°
HAKCAKHAKA110.8°109.5°
CAMCALCAN108.3°109.5°
CAMCALHAL109.8°109.5°
CAMCALHALA109.8°109.5°
CALCAMCAO111.2°109.5°
CALCAMHAM108.9°109.5°
CALCAMHAMA108.9°109.5°
CANCALHAL109.9°109.5°
CANCALHALA109.9°109.4°
CALCANCAP111.1°109.5°
CALCANHAN108.9°109.5°
CALCANHANA109.0°109.4°
HALCALHALA109.1°109.5°
CAOCAMHAM108.9°109.4°
CAOCAMHAMA108.9°109.5°
CAMCAOOAW105.4°109.5°
CAMCAOHAO110.9°109.5°
CAMCAOHAOA110.9°109.5°
HAMCAMHAMA110.0°109.5°
CAPCANHAN109.0°109.5°
CAPCANHANA108.9°109.5°
CANCAPCAX110.7°109.4°
CANCAPHAP109.1°109.5°
CANCAPHAPA109.1°109.5°
HANCANHANA110.0°109.5°
OAWCAOHAO110.9°109.4°
OAWCAOHAOA110.9°109.4°
CAOOAWCAZ105.4°117.0°
HAOCAOHAOA108.0°109.5°
CAXCAPHAP109.0°109.5°
CAXCAPHAPA109.1°109.4°
CAPCAXOAV121.8°120.0°
HAPCAPHAPA109.9°109.5°
CBDCAQCBC115.0°109.5°
CBDCAQHAQ107.7°109.5°
CBDCAQHAQA107.6°109.5°
CAQCBDCBE121.8°120.0°
CBCCAQHAQ107.6°109.4°
CBCCAQHAQA107.7°109.5°
CAQCBCCBB121.7°120.0°
HAQCAQHAQA111.2°109.5°
OAUCBECBD120.0°120.0°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
N1C2N3NAD177.2°179.9°
N1C2N3C41.7°0.1°
C2N1C6C52.9°0.1°
C2N1C6NAE178.9°180.0°
N1C2NADHNAD0.0°0.1°
N1C2NADHNAA120.0°180.0°
C6N1C2N31.8°0.1°
C6N1C2NAD178.9°180.0°
N1C6C5C43.7°0.1°
N1C6C5CBB179.1°180.0°
N1C6C5NAE178.1°180.0°
N1C6NAEHNAE0.0°138.7°
N1C6NAEHNAB120.0°41.2°
C2N3C4NAR178.8°180.0°
C2N3C4C52.8°0.0°
N3C2NADHNAD177.2°180.0°
N3C2NADHNAA57.2°0.0°
NADC2N3C4178.9°180.0°
C2NADHNADHNAA120.0°180.0°
N3C4NARC5178.4°179.9°
N3C4C5CBB178.9°180.0°
N3C4C5C63.7°0.1°
N3C4NARCAI177.4°180.0°
NARC4C5CBB0.6°0.1°
NARC4C5C6178.0°180.0°
C4NARCAICBC2.2°0.1°
C4NARCAIHAI177.8°180.0°
C4C5CBBC6177.1°180.0°
C4C5C6NAE178.3°180.0°
C4C5CBBCAC178.7°180.0°
C5C4NARCAI1.1°0.1°
C4C5CBBCBC1.0°0.0°
CBBC5C6NAE1.1°0.0°
C5CBBCACCBC179.8°179.9°
C5CBBCACHAC89.9°82.8°
C5CBBCACHACA150.1°157.2°
C5CBBCACHACB30.1°37.2°
C5CBBCBCCAI0.0°0.0°
C5CBBCBCCAQ179.7°180.0°
C6C5CBBCAC1.6°0.1°
C5C6NAEHNAE178.1°41.2°
C5C6NAEHNAB61.8°138.8°
C6C5CBBCBC178.2°180.0°
C6NAEHNAEHNAB120.0°180.0°
CAKCAAHAAHAAA120.0°120.1°
CAKCAAHAAHAAB120.0°120.0°
CAKCAAHAAAHAAB120.0°120.0°
CAACAKOAVHAK120.0°120.0°
CAACAKOAVHAKA120.0°120.0°
CAACAKHAKHAKA118.3°120.0°
CAACAKOAVCAX56.8°180.0°
HAACAAHAAAHAAB120.0°120.0°
HAACAACAKOAV180.0°60.0°
HAACAACAKHAK60.0°180.0°
HAACAACAKHAKA60.0°60.0°
HAAACAACAKOAV60.0°180.0°
HAAACAACAKHAK60.0°59.9°
HAAACAACAKHAKA180.0°60.0°
HAABCAACAKOAV60.0°60.1°
HAABCAACAKHAK180.0°60.0°
HAABCAACAKHAKA60.0°180.0°
OAUCABHABHABA120.0°120.0°
OAUCABHABHABB120.0°120.0°
OAUCABHABAHABB120.0°120.0°
CABOAUCBECAH166.8°0.0°
CABOAUCBECBD13.7°180.0°
HABCABHABAHABB120.0°120.0°
HABCABOAUCBE180.0°59.9°
HABACABOAUCBE60.0°60.0°
HABBCABOAUCBE60.0°180.0°
CBBCACHACHACA120.0°120.0°
CBBCACHACHACB120.0°120.0°
CBBCACHACAHACB120.0°119.9°
CACCBBCBCCAI179.8°180.0°
CACCBBCBCCAQ0.5°0.1°
HACCACHACAHACB119.9°120.0°
HACCACCBBCBC89.9°97.2°
HACACACCBBCBC30.1°22.9°
HACBCACCBBCBC150.1°142.8°
OAFCAXOAVCAK29.4°0.1°
OAFCAXCAPCAN97.3°0.0°
OAFCAXCAPOAV177.5°179.9°
OAFCAXCAPHAP22.7°120.0°
OAFCAXCAPHAPA142.7°120.0°
CAHCAGCAZHAG180.0°179.7°
CAGCAHCBEHAH180.0°180.0°
CAHCAGCAZCAJ0.1°0.3°
CAGCAHCBEOAU179.9°180.0°
CAHCAGCAZOAW179.5°179.7°
CAGCAHCBECBD0.6°0.1°
CAZCAGCAHCBE0.2°0.1°
CAZCAGCAHHAH179.8°180.0°
CAGCAZCAJOAW179.4°180.0°
CAGCAZCAJCBD0.3°0.5°
CAGCAZCAJHAJ179.7°180.0°
CAGCAZOAWCAO17.3°0.0°
HAGCAGCAHCBE179.9°179.8°
HAGCAGCAHHAH0.1°0.3°
HAGCAGCAZCAJ180.0°180.0°
HAGCAGCAZOAW0.5°0.0°
CAHCBECBDCAJ0.8°0.3°
CAHCBECBDCAQ180.0°179.8°
CAHCBEOAUCBD179.5°180.0°
HAHCAHCBEOAU0.1°0.0°
HAHCAHCBECBD179.5°180.0°
NARCAICBCHAI180.0°179.9°
NARCAICBCCAQ178.6°180.0°
NARCAICBCCBB1.7°0.1°
CAICBCCAQCBD5.5°95.0°
CAICBCCAQCBB179.7°180.0°
CAICBCCAQHAQ114.5°25.0°
CAICBCCAQHAQA125.5°145.0°
HAICAICBCCAQ1.4°0.1°
HAICAICBCCBB178.3°180.0°
CAZCAJCBDHAJ180.0°179.5°
CAJCAZOAWCAO163.3°180.0°
CAZCAJCBDCAQ179.9°179.5°
CAZCAJCBDCBE0.6°0.5°
CAJCBDCAQCBE179.2°180.0°
CAJCBDCAQCBC95.4°95.1°
CAJCBDCAQHAQ24.6°145.0°
CAJCBDCAQHAQA144.6°25.0°
CAJCBDCBEOAU179.7°179.8°
CBDCAJCAZOAW179.7°179.5°
HAJCAJCBDCAQ0.1°0.1°
HAJCAJCAZOAW0.3°0.0°
HAJCAJCBDCBE179.4°180.0°
OAVCAKHAKHAKA118.3°120.0°
CAKOAVCAXCAP148.1°180.0°
HAKCAKOAVCAX63.3°59.9°
HAKACAKOAVCAX176.7°60.0°
CAMCALCANHAL120.0°120.0°
CAMCALCANHALA120.0°120.0°
CAMCALHALHALA120.5°120.0°
CALCAMCAOHAM120.0°120.0°
CALCAMCAOHAMA120.0°120.0°
CALCAMHAMHAMA119.3°120.0°
CAMCALCANCAP66.8°180.0°
CAMCALCANHAN173.2°60.0°
CAMCALCANHANA53.2°60.0°
CALCAMCAOOAW41.5°180.0°
CALCAMCAOHAO78.5°60.0°
CALCAMCAOHAOA161.5°60.1°
CANCALHALHALA120.5°119.9°
CANCALCAMCAO130.0°180.0°
CANCALCAMHAM10.0°60.0°
CANCALCAMHAMA110.0°60.0°
CALCANCAPHAN120.0°120.0°
CALCANCAPHANA120.0°119.9°
CALCANHANHANA119.4°120.0°
CALCANCAPCAX113.9°180.0°
CALCANCAPHAP126.1°60.0°
CALCANCAPHAPA6.1°60.1°
HALCALCAMCAO10.0°60.0°
HALCALCAMHAM110.0°60.0°
HALCALCAMHAMA130.0°180.0°
HALCALCANCAP53.2°60.0°
HALCALCANHAN66.8°180.0°
HALCALCANHANA173.2°60.0°
HALACALCAMCAO110.0°60.0°
HALACALCAMHAM130.0°NaN°
HALACALCAMHAMA10.0°60.0°
HALACALCANCAP173.2°60.0°
HALACALCANHAN53.2°60.0°
HALACALCANHANA66.8°180.0°
CAOCAMHAMHAMA119.3°120.0°
CAMCAOOAWHAO120.0°120.0°
CAMCAOOAWHAOA120.0°120.0°
CAMCAOHAOHAOA121.7°120.1°
CAMCAOOAWCAZ127.2°180.0°
HAMCAMCAOOAW161.5°60.0°
HAMCAMCAOHAO41.5°180.0°
HAMCAMCAOHAOA78.5°59.9°
HAMACAMCAOOAW78.5°60.0°
HAMACAMCAOHAO161.5°60.0°
HAMACAMCAOHAOA41.5°179.9°
CAPCANHANHANA119.3°120.0°
CANCAPCAXHAP120.0°120.0°
CANCAPCAXHAPA120.0°120.0°
CANCAPHAPHAPA119.5°120.0°
CANCAPCAXOAV80.1°179.9°
HANCANCAPCAX6.0°60.0°
HANCANCAPHAP114.0°NaN°
HANCANCAPHAPA126.1°59.9°
HANACANCAPCAX126.1°60.0°
HANACANCAPHAP6.1°59.9°
HANACANCAPHAPA113.9°180.0°
OAWCAOHAOHAOA121.7°119.9°
HAOCAOOAWCAZ112.8°60.0°
HAOACAOOAWCAZ7.2°60.0°
CAXCAPHAPHAPA119.5°120.0°
HAPCAPCAXOAV159.9°60.1°
HAPACAPCAXOAV39.9°60.0°
CBDCAQCBCHAQ120.0°120.0°
CBDCAQCBCHAQA120.0°120.0°
CBDCAQHAQHAQA117.7°120.1°
CAQCBDCBEOAU0.5°0.2°
CBDCAQCBCCBB174.2°85.0°
CBCCAQHAQHAQA117.7°120.0°
CBCCAQCBDCBE85.4°85.0°
HAQCAQCBCCBB65.8°155.0°
HAQCAQCBDCBE154.7°34.9°
HAQACAQCBCCBB54.2°35.0°
HAQACAQCBDCBE34.7°155.0°

248636

PDB entries from 2026-02-04

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