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ZQB

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C3N1sing1.46Å1.47Å
C3C2sing1.53Å1.50Å
N1C4sing1.33Å1.33Å
C2C1sing1.53Å1.52Å
C1C5sing1.53Å1.54Å
C4O1doub1.21Å1.24Å
C4C5sing1.50Å1.50Å
C5C6sing1.53Å1.52Å
C6C7sing1.53Å1.53Å
N3C8doub1.28Å1.28Å
C7C8sing1.51Å1.52Å
C7N2sing1.46Å1.46Å
O2C9doub1.21Å1.23Å
N2C9sing1.35Å1.33Å
C9C10sing1.51Å1.53Å
CL1C20sing1.74Å1.73Å
O3C15doub1.22Å1.23Å
N5C17sing1.38Å1.35ÅAromatic
N5C16sing1.38Å1.37ÅAromatic
C15C16sing1.47Å1.45Å
C15N4sing1.35Å1.35Å
C20C17doub1.39Å1.39ÅAromatic
C20C21sing1.38Å1.37ÅAromatic
C17C18sing1.41Å1.41ÅAromatic
C10N4sing1.46Å1.45Å
C10C11sing1.53Å1.52Å
C16C19doub1.36Å1.36ÅAromatic
C21C22doub1.39Å1.38ÅAromatic
C18C19sing1.42Å1.42ÅAromatic
C18C23doub1.40Å1.40ÅAromatic
C11C12sing1.53Å1.49Å
C22C23sing1.36Å1.37ÅAromatic
C12C14sing1.53Å1.50Å
C12C13sing1.53Å1.50Å
C14C13sing1.53Å1.50Å
C11H1sing1.09Å1.10Å
C11H2sing1.09Å1.10Å
C13H3sing1.09Å1.10Å
C13H4sing1.09Å1.10Å
C19H5sing1.08Å1.08Å
C21H6sing1.08Å1.08Å
C22H7sing1.08Å1.08Å
C23H8sing1.08Å1.08Å
C14H9sing1.09Å1.10Å
C14H10sing1.09Å1.10Å
C1H11sing1.09Å1.10Å
C1H12sing1.09Å1.10Å
C2H13sing1.09Å1.10Å
C2H14sing1.09Å1.10Å
C3H15sing1.09Å1.10Å
C3H16sing1.09Å1.10Å
N1H17sing0.97Å1.00Å
C5H18sing1.09Å1.10Å
C6H19sing1.09Å1.10Å
C6H20sing1.09Å1.10Å
C7H21sing1.09Å1.10Å
C8H22sing1.08Å1.08Å
N2H23sing0.97Å1.00Å
C10H24sing1.09Å1.10Å
N3H25sing0.97Å1.00Å
N4H26sing0.97Å1.00Å
C12H27sing1.09Å1.10Å
N5H28sing0.97Å1.00Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
N1C3C2112.4°110.5°
C3N1C4128.1°124.1°
N1C3H15108.7°109.3°
N1C3H16108.7°109.3°
C3N1H17115.9°118.0°
C3C2C1107.7°108.7°
C3C2H13109.9°109.5°
C3C2H14109.9°109.7°
C2C3H15108.7°109.3°
C2C3H16108.7°109.3°
N1C4O1122.9°118.3°
N1C4C5118.4°123.5°
C4N1H17115.9°117.9°
C2C1C5113.3°108.4°
C2C1H11108.5°109.7°
C2C1H12108.5°109.7°
C1C2H13109.9°109.6°
C1C2H14109.9°109.6°
C1C5C4113.2°109.9°
C1C5C6113.7°109.4°
C5C1H11108.5°109.7°
C5C1H12108.5°109.6°
C1C5H18106.7°109.4°
O1C4C5118.7°118.2°
C4C5C6108.8°109.4°
C4C5H18107.2°109.4°
C5C6C7108.9°109.5°
C6C5H18106.9°109.4°
C5C6H19109.6°109.5°
C5C6H20109.6°109.4°
C6C7C8111.4°109.5°
C6C7N2108.1°109.5°
C7C6H19109.6°109.6°
C7C6H20109.6°109.5°
C6C7H21107.7°109.5°
N3C8C7122.2°120.0°
N3C8H22118.9°120.0°
C8N3H25112.0°120.0°
C8C7N2113.2°109.4°
C8C7H21107.7°109.4°
C7C8H22118.9°120.0°
C7N2C9122.3°120.0°
N2C7H21108.5°109.5°
C7N2H23118.8°120.0°
O2C9N2123.3°120.0°
O2C9C10121.4°120.0°
N2C9C10115.0°120.0°
C9N2H23118.9°120.0°
C9C10N4111.3°109.4°
C9C10C11108.8°109.5°
C9C10H24108.3°109.5°
CL1C20C17121.9°120.1°
CL1C20C21119.6°120.1°
O3C15C16118.9°120.0°
O3C15N4123.1°120.0°
C17N5C16108.8°108.8°
N5C17C20131.7°133.2°
N5C17C18107.3°107.4°
C17N5H28125.6°125.6°
N5C16C15113.2°125.4°
N5C16C19110.5°109.2°
C16N5H28125.6°125.6°
C16C15N4117.7°120.0°
C15C16C19135.9°125.4°
C15N4C10122.3°120.0°
C15N4H26118.9°120.0°
C17C20C21118.5°119.7°
C20C17C18121.0°119.4°
C20C21C22120.7°120.7°
C20C21H6119.6°119.7°
C17C18C19107.6°107.0°
C17C18C23118.9°119.7°
N4C10C11110.6°109.5°
N4C10H24109.3°109.5°
C10N4H26118.8°120.1°
C10C11C12108.3°109.5°
C10C11H1109.7°109.5°
C10C11H2109.8°109.5°
C11C10H24108.4°109.5°
C16C19C18105.8°107.7°
C16C19H5127.1°126.2°
C21C22C23122.0°120.6°
C22C21H6119.6°119.6°
C21C22H7119.0°119.7°
C19C18C23133.5°133.4°
C18C19H5127.1°126.1°
C18C23C22118.9°119.8°
C18C23H8120.5°120.0°
C11C12C14119.0°117.5°
C11C12C13120.3°117.5°
C12C11H1109.8°109.5°
C12C11H2109.8°109.4°
C11C12H27115.4°115.6°
C23C22H7119.0°119.7°
C22C23H8120.6°120.1°
C14C12C1360.2°60.0°
C12C14C1359.9°60.0°
C12C14H9120.0°117.5°
C12C14H10120.0°117.5°
C14C12H27115.4°117.5°
C12C13C1459.9°60.0°
C12C13H3120.0°117.4°
C12C13H4120.0°117.5°
C13C12H27115.4°117.5°
C14C13H3120.0°117.4°
C14C13H4120.0°117.5°
C13C14H9120.0°117.4°
C13C14H10120.0°117.5°
H1C11H2109.5°109.5°
H3C13H4109.5°115.6°
H9C14H10109.5°115.6°
H11C1H12109.4°109.7°
H13C2H14109.5°109.6°
H15C3H16109.5°109.1°
H19C6H20109.5°109.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
N1C3C2H15120.4°120.3°
N1C3C2H16120.4°120.3°
C3N1C4H17180.0°180.0°
N1C3C2C146.2°50.8°
C3N1C4O1179.2°177.8°
C3N1C4C52.1°2.2°
N1C3C2H1373.5°170.5°
N1C3C2H14166.0°69.1°
N1C3H15H16118.7°119.5°
C2C3N1C417.5°19.0°
C3C2C1H13119.7°119.7°
C3C2C1H14119.7°119.9°
C3C2C1C560.0°67.6°
C3C2C1H11179.4°172.7°
C3C2C1H1260.6°52.2°
C3C2H13H14120.8°120.5°
C2C3H15H16118.7°119.5°
C2C3N1H17162.5°161.0°
N1C4C5C110.0°17.5°
N1C4O1C5178.7°180.0°
N1C4C5C6137.4°137.7°
C4N1C3H15137.9°101.3°
C4N1C3H16102.9°139.4°
N1C4C5H18107.4°102.6°
C2C1C5H11120.6°119.7°
C2C1C5H12120.6°119.8°
C2C1C5C441.8°48.9°
C2C1C5C6166.6°169.0°
C2C1H11H12118.2°120.6°
C1C2H13H14120.8°120.3°
C1C2C3H15166.7°69.5°
C1C2C3H1674.2°171.1°
C2C1C5H1875.8°71.2°
C1C5C4O1168.8°162.4°
C1C5C4C6127.4°120.1°
C1C5C4H18117.3°120.1°
C1C5C6H18117.4°119.8°
C1C5C6C759.7°65.3°
C5C1H11H12118.3°120.5°
C5C1C2H1359.8°172.7°
C5C1C2H14179.7°52.4°
C1C5C6H1960.2°54.8°
C1C5C6H20179.6°174.7°
O1C4C5C641.3°42.3°
O1C4N1H170.8°2.2°
O1C4C5H1873.9°77.5°
C4C5C6H18115.4°119.8°
C4C5C6C7173.2°174.3°
C4C5C1H11162.4°168.6°
C4C5C1H1278.8°70.9°
C5C4N1H17177.9°177.8°
C4C5C6H1966.9°65.6°
C4C5C6H2053.2°54.3°
C5C6C7H19119.9°120.0°
C5C6C7H20119.9°119.9°
C5C6C7C8178.8°175.3°
C5C6C7N256.2°64.7°
C6C5C1H1172.8°71.2°
C6C5C1H1246.1°49.3°
C5C6H19H20120.2°119.9°
C5C6C7H2160.9°55.3°
C6C7C8N391.9°120.0°
C6C7C8N2122.1°120.0°
C6C7C8H21117.9°120.0°
C6C7N2H21116.5°120.1°
C6C7N2C9129.5°153.2°
C7C6C5H1857.7°54.5°
C7C6H19H20120.3°120.1°
C6C7C8H2288.1°60.0°
C6C7N2H2350.5°26.7°
N3C8C7H22180.0°180.0°
N3C8C7N2146.0°0.0°
N3C8C7H2126.0°120.0°
C8C7N2H21119.5°120.0°
C8C7N2C9106.5°86.8°
C8C7C6H1958.9°55.2°
C8C7C6H2061.3°64.8°
C8C7N2H2373.5°93.3°
C7C8N3H25180.0°180.0°
C7N2C9O23.4°0.1°
C7N2C9H23180.0°179.9°
C7N2C9C10170.6°180.0°
N2C7C6H19176.1°175.2°
N2C7C6H2063.7°55.2°
N2C7C8H2234.0°180.0°
O2C9N2C10173.9°180.0°
O2C9C10N459.4°0.0°
O2C9C10C1162.7°120.0°
O2C9N2H23176.6°179.9°
O2C9C10H24179.6°120.0°
N2C9C10N4126.5°180.0°
N2C9C10C11111.3°60.0°
C9N2C7H2113.0°33.2°
N2C9C10H246.3°60.0°
C9C10N4C1574.7°155.0°
C9C10N4C11121.1°120.0°
C9C10N4H24119.6°120.0°
C9C10C11H24117.6°120.0°
C9C10C11C12176.6°175.0°
C9C10C11H156.8°65.0°
C9C10C11H263.6°55.0°
C10C9N2H239.4°0.1°
C9C10N4H26105.2°25.0°
CL1C20C17N52.4°0.1°
CL1C20C17C21178.9°179.9°
CL1C20C17C18179.4°179.9°
CL1C20C21C22178.7°180.0°
CL1C20C21H61.3°0.1°
O3C15C16N55.0°179.7°
O3C15C16N4173.3°179.9°
O3C15N4C101.2°0.0°
O3C15C16C19167.2°0.1°
O3C15N4H26178.8°180.0°
C17N5C16H28180.0°179.8°
C17N5C16C15175.9°179.9°
N5C17C20C18178.2°180.0°
N5C17C20C21178.7°180.0°
C17N5C16C191.7°0.3°
N5C17C18C190.4°0.0°
N5C17C18C23179.7°180.0°
N5C16C15C19172.1°179.6°
N5C16C15N4178.2°0.4°
C16N5C17C20177.6°179.8°
C16N5C17C180.8°0.2°
N5C16C19C181.9°0.3°
N5C16C19H5178.1°179.8°
C16C15N4C10171.7°180.0°
C15C16C19C18174.2°179.9°
C15C16C19H55.8°0.1°
C16C15N4H268.3°0.1°
C15C16N5H284.1°0.3°
C15N4C10H26180.0°180.0°
C15N4C10C11164.1°85.0°
N4C15C16C196.1°180.0°
C15N4C10H2444.8°35.0°
C17C20C21C220.2°0.1°
C20C17C18C19179.0°180.0°
C20C17C18C231.7°0.0°
C17C20C21H6179.7°180.0°
C20C17N5H282.4°0.0°
C21C20C17C180.5°0.1°
C20C21C22H6180.0°179.9°
C20C21C22C230.2°0.2°
C20C21C22H7179.8°180.0°
C17C18C19C161.4°0.2°
C17C18C19C23179.1°180.0°
C17C18C23C222.1°0.0°
C17C18C19H5178.6°179.9°
C17C18C23H8177.9°180.0°
C18C17N5H28179.2°180.0°
N4C10C11H24119.8°120.0°
N4C10C11C1254.0°65.1°
N4C10C11H165.8°55.0°
N4C10C11H2173.8°175.0°
C10C11C12H1119.8°120.1°
C10C11C12H2119.8°120.0°
C10C11C12C1460.9°175.0°
C10C11C12C13131.3°116.4°
C10C11H1H2120.6°120.0°
C11C10N4H2615.9°95.0°
C10C11C12H2782.8°29.3°
C16C19C18H5180.0°179.9°
C16C19C18C23179.5°179.8°
C19C16N5H28178.3°179.9°
C21C22C23C181.4°0.1°
C21C22C23H7180.0°179.8°
C21C22C23H8178.6°179.9°
C19C18C23C22178.8°180.0°
C19C18C23H81.2°0.0°
C18C23C22H8180.0°180.0°
C23C18C19H50.5°0.2°
C18C23C22H7178.6°179.9°
C11C12C14C13110.4°107.5°
C11C12C14H27143.7°145.0°
C11C12C13H27145.9°145.0°
C12C11H1H2120.5°120.0°
C11C12C13H3142.4°0.1°
C11C12C13H41.3°145.0°
C11C12C14H90.9°145.1°
C11C12C14H10140.2°0.0°
C12C11C10H2465.8°55.0°
C23C22C21H6179.8°180.0°
C14C12C13H27106.0°107.5°
C12C14C13H9109.4°107.5°
C12C14C13H10109.4°107.5°
C14C12C11H1179.4°65.0°
C14C12C11H259.0°55.0°
C14C12C13H3109.4°107.4°
C14C12C13H4109.5°107.5°
C12C14H9H10144.8°145.8°
C13C12C11H1108.9°3.7°
C13C12C11H211.5°123.7°
C12C13H3H4144.8°145.7°
C14C13H3H4144.8°145.7°
C13C14H9H10144.8°145.7°
H1C11C10H24174.4°175.0°
H1C11C12H2737.0°149.3°
H2C11C10H2454.0°65.0°
H2C11C12H27157.4°90.7°
H3C13C14H9141.1°145.1°
H3C13C14H100.0°0.0°
H3C13C12H273.5°145.0°
H4C13C14H90.0°0.0°
H4C13C14H10141.2°145.0°
H4C13C12H27144.6°0.0°
H6C21C22H70.2°0.1°
H7C22C23H81.4°0.1°
H9C14C12H27144.6°0.0°
H10C14C12H273.5°145.0°
H11C1C2H1360.8°53.0°
H11C1C2H1459.7°67.3°
H11C1C5H1844.7°48.5°
H12C1C2H13179.7°67.5°
H12C1C2H1459.1°172.1°
H12C1C5H18163.6°169.0°
H13C2C3H1546.9°50.2°
H13C2C3H16166.1°69.2°
H14C2C3H1573.6°170.6°
H14C2C3H1645.5°51.2°
H15C3N1H1742.1°78.7°
H16C3N1H1777.1°40.6°
H18C5C6H19177.6°174.6°
H18C5C6H2062.2°65.5°
H19C6C7H2159.0°64.7°
H20C6C7H21179.2°175.3°
H21C7C8H22154.0°60.0°
H21C7N2H23167.0°146.7°
H22C8N3H250.1°0.0°
H24C10N4H26135.2°144.9°

226707

PDB entries from 2024-10-30

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