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6D6

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
N6C15sing1.38Å1.43Å
C15N7doub1.33Å1.34ÅAromatic
C15C9sing1.41Å1.41ÅAromatic
N5C9sing1.35Å1.36ÅAromatic
N5C8doub1.30Å1.35ÅAromatic
N7C16sing1.32Å1.34ÅAromatic
C9C17doub1.40Å1.37ÅAromatic
C8N4sing1.36Å1.34ÅAromatic
C16N8doub1.32Å1.36ÅAromatic
C17N4sing1.37Å1.37ÅAromatic
C17N8sing1.33Å1.36ÅAromatic
N4C13sing1.47Å1.44Å
N1C1sing1.47Å1.42Å
C13C14sing1.55Å1.52Å
C13O3sing1.44Å1.50Å
C14O4sing1.43Å1.43Å
C14C7sing1.55Å1.46Å
O3C12sing1.44Å1.47Å
C1C2sing1.53Å1.54Å
C2C3sing1.53Å1.53Å
C6C12sing1.53Å1.60Å
C6N2sing1.47Å1.44Å
C7C12sing1.54Å1.48Å
C7O5sing1.43Å1.45Å
C3N2sing1.47Å1.46Å
N2C4sing1.47Å1.48Å
C4C10sing1.53Å1.58Å
C10C5sing1.53Å1.51Å
N3C5sing1.47Å1.45Å
C5C11sing1.51Å1.56Å
O1C11doub1.21Å1.28Å
C11O2sing1.34Å1.28Å
C1H1sing1.09Å1.10Å
C1H2sing1.09Å1.10Å
C2H3sing1.09Å1.10Å
C2H4sing1.09Å1.10Å
C3H5sing1.09Å1.10Å
C3H6sing1.09Å1.10Å
C4H7sing1.09Å1.10Å
C4H8sing1.09Å1.10Å
C5H9sing1.09Å1.10Å
C6H10sing1.09Å1.10Å
C6H11sing1.09Å1.10Å
C7H12sing1.09Å1.10Å
C8H13sing1.08Å1.08Å
N1H14sing1.01Å1.00Å
N1H15sing1.01Å1.00Å
C10H18sing1.09Å1.10Å
C10H19sing1.09Å1.10Å
N3H20sing1.01Å1.00Å
N3H21sing1.01Å1.00Å
O2H23sing0.97Å0.95Å
C12H24sing1.09Å1.10Å
C13H25sing1.09Å1.10Å
C14H26sing1.09Å1.10Å
O4H27sing0.97Å0.95Å
O5H28sing0.97Å0.95Å
N6H29sing0.97Å1.00Å
N6H30sing0.97Å1.00Å
C16H31sing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
N6C15N7121.5°120.8°
N6C15C9119.0°120.8°
C15N6H29109.5°120.0°
C15N6H30109.5°119.9°
N7C15C9119.4°118.4°
C15N7C16120.5°121.2°
C15C9N5133.7°134.7°
C15C9C17118.7°118.2°
C9N5C8108.2°109.4°
N5C9C17107.5°107.1°
N5C8N4108.6°110.0°
N5C8H13125.7°125.0°
N7C16N8121.7°122.5°
N7C16H31119.2°118.8°
C9C17N4107.0°106.0°
C9C17N8120.4°119.1°
C8N4C17108.6°107.4°
C8N4C13127.9°126.3°
N4C8H13125.7°125.1°
C16N8C17119.2°120.6°
N8C16H31119.1°118.7°
N4C17N8132.6°134.9°
C17N4C13123.3°126.3°
N4C13C14108.7°110.6°
N4C13O3114.7°110.6°
N4C13H25110.2°110.7°
N1C1C2110.1°109.5°
N1C1H1109.3°109.5°
N1C1H2109.4°109.5°
C1N1H14109.5°111.0°
C1N1H15109.5°111.0°
C14C13O3104.5°103.5°
C13C14O4111.1°110.9°
C13C14C7103.6°102.1°
C14C13H25109.1°110.7°
C13C14H26109.2°110.9°
C13O3C12107.0°106.9°
O3C13H25109.4°110.6°
O4C14C7112.2°110.9°
O4C14H26110.5°110.8°
C14O4H27109.5°114.0°
C14C7C12107.6°104.2°
C14C7O5110.5°110.5°
C14C7H12110.3°110.6°
C7C14H26110.0°110.9°
O3C12C6108.8°109.9°
O3C12C7107.2°107.3°
O3C12H24110.1°110.0°
C1C2C3109.3°109.5°
C2C1H1109.3°109.5°
C2C1H2109.3°109.5°
C1C2H3109.5°109.4°
C1C2H4109.5°109.4°
C2C3N2115.8°109.5°
C3C2H3109.5°109.5°
C3C2H4109.5°109.5°
C2C3H5107.8°109.5°
C2C3H6107.8°109.5°
C12C6N2109.5°109.4°
C6C12C7112.4°109.8°
C12C6H10109.5°109.4°
C12C6H11109.5°109.5°
C6C12H24108.4°109.9°
C6N2C3111.1°111.0°
C6N2C4113.3°111.0°
N2C6H10109.4°109.5°
N2C6H11109.4°109.5°
C12C7O5107.7°110.5°
C12C7H12110.1°110.5°
C7C12H24109.9°109.8°
O5C7H12110.5°110.4°
C7O5H28109.5°114.0°
C3N2C4111.0°111.0°
N2C3H5107.8°109.5°
N2C3H6107.9°109.5°
N2C4C10110.6°109.5°
N2C4H7109.2°109.5°
N2C4H8109.2°109.5°
C4C10C5114.1°109.5°
C10C4H7109.2°109.5°
C10C4H8109.2°109.4°
C4C10H18108.3°109.5°
C4C10H19108.3°109.5°
C10C5N3110.4°109.5°
C10C5C11113.1°109.5°
C10C5H9108.1°109.5°
C5C10H18108.3°109.5°
C5C10H19108.3°109.4°
N3C5C11108.7°109.5°
N3C5H9109.0°109.5°
C5N3H20109.5°111.0°
C5N3H21109.4°111.0°
C5C11O1119.7°120.0°
C5C11O2119.7°120.0°
C11C5H9107.5°109.4°
O1C11O2120.7°120.0°
C11O2H23109.5°117.0°
H1C1H2109.4°109.4°
H3C2H4109.4°109.5°
H5C3H6109.5°109.4°
H7C4H8109.4°109.5°
H10C6H11109.5°109.5°
H14N1H15109.4°111.0°
H18C10H19109.5°109.5°
H20N3H21109.4°110.9°
H29N6H30109.5°120.0°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
N6C15N7C9179.9°179.9°
N6C15C9N50.1°0.5°
N6C15N7C16179.9°180.0°
N6C15C9C17179.9°180.0°
C15N6H29H30120.0°179.9°
N7C15C9N5180.0°179.6°
N7C15C9C170.0°0.1°
C15N7C16N80.1°0.5°
N7C15N6H290.0°0.0°
N7C15N6H30120.0°179.9°
C15N7C16H31179.9°180.0°
C15C9N5C17180.0°179.5°
C15C9N5C8179.5°179.7°
C9C15N7C160.1°0.1°
C15C9C17N4179.3°180.0°
C15C9C17N80.4°0.5°
C9C15N6H29179.9°180.0°
C9C15N6H3060.0°0.0°
C9N5C8N41.5°0.0°
N5C9C17N40.7°0.3°
N5C9C17N8179.6°179.9°
C9N5C8H13178.5°179.8°
C8N5C9C170.5°0.2°
N5C8N4H13180.0°179.7°
N5C8N4C172.0°0.3°
N5C8N4C13177.5°179.7°
N7C16N8H31180.0°179.5°
N7C16N8C170.5°0.9°
C9C17N4C81.6°0.4°
C9C17N8C160.6°0.9°
C9C17N4N8179.6°179.4°
C9C17N4C13177.4°179.6°
C8N4C17C13175.8°180.0°
C8N4C17N8178.7°179.8°
C8N4C13C1450.8°95.0°
C8N4C13O365.7°19.1°
C8N4C13H25170.3°142.0°
C16N8C17N4179.0°179.7°
C17N4C13C14134.2°85.0°
C17N4C13O3109.2°160.9°
C17N4C8H13178.0°180.0°
C17N4C13H2514.7°38.0°
N8C17N4C132.9°0.2°
C17N8C16H31179.5°179.6°
N4C13C14O3122.9°118.5°
N4C13C14H25120.2°123.0°
N4C13O3H25124.4°122.9°
N4C13C14O485.1°86.3°
N4C13C14C7154.2°155.5°
N4C13O3C12141.0°158.6°
C13N4C8H132.5°0.0°
N4C13C14H2637.1°37.3°
N1C1C2H1120.1°120.0°
N1C1C2H2120.1°120.0°
N1C1C2C3175.6°180.0°
N1C1H1H2119.8°120.0°
N1C1C2H355.7°60.0°
N1C1C2H464.4°60.0°
C1N1H14H15120.0°124.0°
C14C13O3H25116.7°118.5°
C13C14O4C7115.4°112.7°
C13C14O4H26121.4°123.6°
C13C14C7H26116.6°118.2°
C14C13O3C1222.1°40.1°
C13C14C7C1229.3°20.9°
C13C14C7O588.1°97.8°
C13C14C7H12149.4°139.6°
C13C14O4H27180.0°180.0°
O3C13C14O4152.0°155.2°
O3C13C14C731.3°37.0°
C13O3C12C6126.2°145.9°
C13O3C12C74.4°26.5°
C13O3C12H24115.1°93.0°
O3C13C14H2685.8°81.2°
O4C14C7H26123.5°123.6°
O4C14C7C12149.2°139.1°
O4C14C7O531.9°20.4°
O4C14C7H1290.7°102.1°
O4C14C13H2535.1°36.7°
C14C7C12O316.0°2.1°
C14C7C12C6103.6°121.5°
C14C7C12O5119.1°118.7°
C14C7C12H12120.2°118.8°
C14C7O5H12122.4°122.7°
C14C7C12H24135.7°117.5°
C7C14C13H2585.6°81.5°
C7C14O4H2764.6°67.3°
C14C7O5H28180.0°65.2°
O3C12C6C7118.7°117.8°
O3C12C6H24119.7°121.2°
O3C12C6N2149.1°67.2°
O3C12C7H24119.6°119.6°
O3C12C7O5103.1°120.7°
O3C12C6H1090.9°52.8°
O3C12C6H1129.1°172.9°
O3C12C7H12136.2°116.7°
C12O3C13H2594.6°78.5°
C1C2C3H3120.0°120.0°
C1C2C3H4120.0°120.0°
C1C2C3N2169.8°174.6°
C2C1H1H2119.7°120.0°
C1C2H3H4120.1°119.9°
C1C2C3H569.3°65.4°
C1C2C3H648.8°54.6°
C2C1N1H14180.0°56.1°
C2C1N1H1560.0°180.0°
C2C3N2C640.5°163.6°
C2C3N2H5120.9°120.1°
C2C3N2H6120.9°120.0°
C2C3N2C486.4°72.4°
C3C2C1H164.3°60.0°
C3C2C1H255.5°60.0°
C3C2H3H4120.1°120.1°
C2C3H5H6117.1°120.0°
C12C6N2H10120.0°119.9°
C12C6N2H11120.0°120.0°
C6C12C7H24120.8°121.0°
C6C12C7O5137.3°119.9°
C12C6N2C3159.1°66.1°
C12C6N2C475.2°170.0°
C12C6H10H11120.0°120.0°
C6C12C7H1216.7°2.7°
N2C6C12C792.2°175.0°
C6N2C3C4127.0°124.0°
C6N2C4C10105.4°72.4°
C6N2C3H580.4°76.3°
C6N2C3H6161.4°43.6°
C6N2C4H7134.5°167.6°
C6N2C4H814.8°47.6°
N2C6H10H11120.0°120.1°
N2C6C12H2429.4°54.1°
C12C7O5H12120.3°122.6°
C7C12C6H1027.8°65.0°
C7C12C6H11147.8°55.0°
C12C7C14H2687.3°97.3°
C12C7O5H2862.7°180.0°
O5C7C12H2416.5°1.1°
O5C7C14H26155.3°144.0°
C3N2C4C10128.9°163.6°
N2C3C2H349.8°54.6°
N2C3C2H470.2°65.5°
N2C3H5H6117.1°120.0°
C3N2C4H78.7°43.6°
C3N2C4H8110.9°76.4°
C3N2C6H1039.1°174.0°
C3N2C6H1180.9°53.9°
N2C4C10H7120.2°120.1°
N2C4C10H8120.2°120.0°
N2C4C10C5178.0°179.0°
C4N2C3H5152.7°47.6°
C4N2C3H634.5°167.6°
N2C4H7H8119.5°120.0°
C4N2C6H10164.8°50.1°
C4N2C6H1144.8°70.0°
N2C4C10H1861.3°58.9°
N2C4C10H1957.4°61.1°
C4C10C5H18120.7°120.1°
C4C10C5H19120.7°120.0°
C4C10C5N350.3°65.0°
C4C10C5C1171.7°175.0°
C10C4H7H8119.5°120.0°
C4C10C5H9169.4°55.1°
C4C10H18H19117.9°120.0°
C10C5N3C11124.5°120.1°
C10C5N3H9118.5°120.0°
C10C5C11H9119.2°120.0°
C10C5C11O1114.2°100.0°
C10C5C11O266.2°80.0°
C5C10C4H757.9°61.0°
C5C10C4H861.8°59.0°
C5C10H18H19117.9°119.9°
C10C5N3H20180.0°60.0°
C10C5N3H2160.0°63.9°
N3C5C11H9117.8°120.0°
N3C5C11O18.8°20.0°
N3C5C11O2170.9°160.0°
N3C5C10H1870.3°175.0°
N3C5C10H19171.0°55.0°
C5N3H20H21120.0°123.9°
C5C11O1O2179.7°180.0°
C11C5C10H18167.6°55.0°
C11C5C10H1949.0°65.0°
C11C5N3H2055.5°60.1°
C11C5N3H2164.5°176.0°
C5C11O2H23179.7°179.9°
O1C11C5H9126.6°140.0°
O1C11O2H230.0°0.1°
O2C11C5H953.0°40.0°
H1C1C2H3175.8°60.1°
H1C1C2H455.7°180.0°
H1C1N1H1459.9°63.9°
H1C1N1H1560.1°60.0°
H2C1C2H364.5°180.0°
H2C1C2H4175.5°60.0°
H2C1N1H1459.9°176.1°
H2C1N1H15179.9°59.9°
H3C2C3H5170.7°174.6°
H3C2C3H671.2°65.4°
H4C2C3H550.7°54.6°
H4C2C3H6168.8°174.6°
H7C4C10H18178.5°179.0°
H7C4C10H1962.8°59.0°
H8C4C10H1858.9°61.0°
H8C4C10H19177.6°178.9°
H9C5C10H1848.8°65.0°
H9C5C10H1969.9°175.0°
H9C5N3H2061.4°180.0°
H9C5N3H21178.6°56.1°
H10C6C12H24149.4°174.0°
H11C6C12H2490.6°65.9°
H12C7C12H24104.1°123.6°
H12C7C14H2632.8°21.4°
H12C7O5H2857.6°57.5°
H25C13C14H26157.3°160.3°
H26C14O4H2758.6°56.3°

222415

PDB entries from 2024-07-10

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