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VLC

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
NCsing1.49Å1.52Å
CC1sing1.55Å1.53Å
C1C2sing1.56Å1.55Å
C2C3sing1.55Å1.53Å
NC3sing1.49Å1.51Å
C3C4sing1.54Å1.54Å
C4N1sing1.47Å1.51Å
C5N1sing1.47Å1.50Å
CC5sing1.54Å1.53Å
N1C6sing1.40Å1.48Å
C6C7doub1.39Å1.38ÅAromatic
C7C8sing1.40Å1.40ÅAromatic
N2C8doub1.33Å1.34ÅAromatic
N3N2sing1.28Å1.34ÅAromatic
C9N3doub1.32Å1.33ÅAromatic
C6C9sing1.40Å1.42ÅAromatic
N4C9sing1.39Å1.34Å
C8C10sing1.48Å1.49Å
C10C11doub1.40Å1.41ÅAromatic
C11Osing1.36Å1.35Å
C12C11sing1.39Å1.39ÅAromatic
C13C12doub1.38Å1.38ÅAromatic
C14C13sing1.38Å1.38ÅAromatic
C15C14doub1.38Å1.39ÅAromatic
C10C15sing1.39Å1.40ÅAromatic
C16Nsing1.39Å1.48Å
C16C17doub1.40Å1.38ÅAromatic
C17C18sing1.38Å1.38ÅAromatic
C18N5doub1.32Å1.34ÅAromatic
N5C19sing1.32Å1.32ÅAromatic
O1C19sing1.36Å1.36Å
C20O1sing1.43Å1.44Å
C21C20sing1.53Å1.50Å
O2C21sing1.43Å1.43Å
C22O2sing1.43Å1.42Å
C19C23doub1.39Å1.40ÅAromatic
C23C16sing1.39Å1.39ÅAromatic
OH15sing0.97Å0.95Å
C12H16sing1.08Å1.08Å
C13H17sing1.08Å1.08Å
C14H18sing1.08Å1.08Å
C15H19sing1.08Å1.08Å
C7H12sing1.08Å1.08Å
N4H14sing0.97Å1.00Å
N4H13sing0.97Å1.00Å
C5H11sing1.09Å1.10Å
C5H10sing1.09Å1.10Å
CH1sing1.09Å1.10Å
C4H9sing1.09Å1.10Å
C4H8sing1.09Å1.10Å
C3H2sing1.09Å1.10Å
C2H7sing1.09Å1.10Å
C2H6sing1.09Å1.10Å
C1H4sing1.09Å1.10Å
C1H5sing1.09Å1.10Å
C23H29sing1.08Å1.08Å
C18H21sing1.08Å1.08Å
C17H20sing1.08Å1.08Å
C20H22sing1.09Å1.10Å
C20H23sing1.09Å1.10Å
C21H25sing1.09Å1.10Å
C21H24sing1.09Å1.10Å
C22H26sing1.09Å1.10Å
C22H28sing1.09Å1.10Å
C22H27sing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
NCC1102.3°104.0°
CNC3104.3°103.0°
NCC5103.7°106.9°
CNC16119.1°111.0°
NCH1112.2°113.0°
CC1C2105.9°104.9°
C1CC5113.8°107.6°
C1CH1112.1°112.4°
CC1H4110.3°110.4°
CC1H5110.4°110.4°
C1C2C3105.9°103.9°
C1C2H7110.4°110.5°
C1C2H6110.4°111.1°
C2C1H4110.3°110.3°
C2C1H5110.3°110.3°
C2C3N102.0°104.6°
C2C3C4113.4°107.6°
C2C3H2112.2°112.4°
C3C2H7110.4°110.4°
C3C2H6110.3°110.4°
NC3C4103.8°106.9°
C3NC16129.6°111.0°
NC3H2112.5°112.4°
C3C4N1111.3°109.0°
C3C4H9109.0°109.6°
C3C4H8109.0°109.7°
C4C3H2112.1°112.3°
C4N1C5113.3°111.6°
C4N1C6116.0°111.0°
N1C4H9109.0°109.6°
N1C4H8109.0°109.5°
N1C5C110.4°109.0°
C5N1C6113.4°111.0°
N1C5H11109.2°109.5°
N1C5H10109.2°109.6°
CC5H11109.2°109.6°
CC5H10109.2°109.7°
C5CH1112.0°112.3°
N1C6C7120.3°121.1°
N1C6C9123.4°121.1°
C6C7C8119.1°117.8°
C7C6C9116.3°117.9°
C6C7H12120.5°121.1°
C7C8N2121.5°119.9°
C7C8C10121.9°120.1°
C8C7H12120.5°121.1°
C8N2N3120.5°122.3°
N2C8C10116.4°120.0°
N2N3C9119.8°122.3°
N3C9C6122.8°119.8°
N3C9N4115.6°120.1°
C6C9N4121.6°120.1°
C9N4H14109.5°120.0°
C9N4H13109.5°120.0°
C8C10C11122.0°120.2°
C8C10C15119.5°120.2°
C10C11O123.6°120.1°
C10C11C12120.5°119.7°
C11C10C15118.1°119.7°
OC11C12115.8°120.1°
C11OH15109.5°114.0°
C11C12C13120.0°120.1°
C11C12H16120.0°119.9°
C12C13C14120.1°120.3°
C13C12H16120.0°120.0°
C12C13H17119.9°119.9°
C13C14C15120.4°120.2°
C14C13H17119.9°119.9°
C13C14H18119.8°119.8°
C14C15C10120.7°120.0°
C15C14H18119.8°119.9°
C14C15H19119.6°120.0°
C10C15H19119.7°120.0°
NC16C17120.5°120.8°
NC16C23120.6°120.8°
C16C17C18118.6°119.2°
C17C16C23118.2°118.4°
C16C17H20120.7°120.4°
C17C18N5124.1°120.9°
C17C18H21118.0°119.6°
C18C17H20120.7°120.4°
C18N5C19116.6°121.8°
N5C18H21117.9°119.5°
N5C19O1119.4°119.7°
N5C19C23124.0°120.7°
C19O1C20117.7°117.0°
O1C19C23116.6°119.6°
O1C20C21109.9°109.4°
O1C20H22109.4°109.4°
O1C20H23109.4°109.5°
C20C21O2114.3°109.5°
C21C20H22109.3°109.5°
C21C20H23109.3°109.5°
C20C21H25108.2°109.5°
C20C21H24108.2°109.4°
C21O2C22113.7°114.0°
O2C21H25108.3°109.5°
O2C21H24108.3°109.5°
O2C22H26109.5°109.5°
O2C22H28109.5°109.5°
O2C22H27109.4°109.5°
C19C23C16118.4°119.0°
C19C23H29120.8°120.5°
C16C23H29120.8°120.5°
H14N4H13109.5°120.0°
H11C5H10109.5°109.5°
H9C4H8109.5°109.6°
H7C2H6109.5°110.4°
H4C1H5109.5°110.4°
H22C20H23109.4°109.5°
H25C21H24109.5°109.5°
H26C22H28109.5°109.4°
H26C22H27109.5°109.4°
H28C22H27109.5°109.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
NCC1C5111.2°113.2°
NCC1H1120.4°122.6°
NCC1C224.2°26.0°
CNC3C243.4°43.1°
CNC3C16149.5°118.8°
CNC3C474.7°70.9°
NCC5N162.3°63.6°
NCC5H1121.3°124.5°
CNC16C1717.1°0.0°
CNC16C23171.8°179.7°
NCC5H11177.6°176.5°
NCC5H1057.9°56.3°
CNC3H2163.9°165.4°
NCC1H4143.7°144.8°
NCC1H595.2°92.8°
CC1C2H4119.4°118.9°
CC1C2H5119.4°118.8°
CC1C2C31.8°0.1°
C1CNC342.3°42.8°
C1CC5N148.0°47.6°
C1CC5H1128.5°124.2°
C1CNC16111.1°76.0°
C1CC5H1172.1°72.2°
C1CC5H10168.2°167.5°
CC1C2H7121.2°118.5°
CC1C2H6117.6°118.7°
CC1H4H5121.7°122.3°
C1C2C3H7119.5°118.5°
C1C2C3H6119.4°119.2°
C1C2C3N27.2°26.0°
C1C2C3C483.8°87.5°
C2C1CC586.9°87.3°
C2C1CH1144.7°148.6°
C1C2C3H2147.9°148.3°
C1C2H7H6121.7°123.3°
C2C1H4H5121.6°122.2°
C2C3NC4118.1°114.0°
C2C3NH2120.5°122.3°
C2C3C4H2128.4°124.2°
C2C3C4N149.9°48.3°
C2C3NC16106.1°75.8°
C2C3C4H970.4°168.2°
C2C3C4H8170.2°71.5°
C3C2H7H6121.6°122.3°
C3C2C1H4117.6°118.9°
C3C2C1H5121.2°118.8°
NC3C4H2121.8°123.8°
NC3C4N159.9°63.6°
C3NCC576.3°70.9°
C3NC16C17162.9°113.9°
C3NC16C2326.1°65.9°
C3NCH1162.6°165.0°
NC3C4H9179.8°56.2°
NC3C4H860.3°176.5°
NC3C2H7146.7°92.6°
NC3C2H692.2°145.1°
C3C4N1H9120.3°119.9°
C3C4N1H8120.3°119.9°
C3C4N1C548.6°55.3°
C3C4N1C6177.8°179.8°
C4C3NC16135.8°170.2°
C3C4H9H8119.2°120.4°
C4C3C2H735.7°153.9°
C4C3C2H6156.8°31.6°
C4N1C5C6134.9°124.4°
C4N1C5C49.7°55.3°
C4N1C6C723.5°64.8°
C4N1C6C9158.1°115.1°
C4N1C5H11169.8°175.2°
C4N1C5H1070.5°64.6°
N1C4H9H8119.1°120.2°
N1C4C3H2178.3°172.6°
N1C5CH11120.1°119.8°
N1C5CH10120.1°119.9°
C5N1C6C7110.1°60.0°
C5N1C6C968.3°120.1°
N1C5H11H10119.5°120.2°
N1C5CH1176.5°171.9°
C5N1C4H9168.9°64.5°
C5N1C4H871.7°175.3°
CC5N1C6175.5°179.8°
C5CNC16130.3°170.2°
CC5H11H10119.6°120.3°
C5CC1H432.5°31.6°
C5CC1H5153.7°153.9°
N1C6C7C9178.5°179.9°
N1C6C7C8177.9°180.0°
N1C6C9N3179.3°179.7°
N1C6C9N40.1°0.1°
N1C6C7H122.1°0.1°
C6N1C5H1155.3°60.4°
C6N1C5H1064.4°59.8°
C6N1C4H957.5°59.9°
C6N1C4H861.9°60.3°
C6C7C8H12180.0°180.0°
C6C7C8N22.0°0.3°
C7C6C9N30.8°0.2°
C7C6C9N4178.5°180.0°
C6C7C8C10175.4°180.0°
C7C8N2C10173.8°179.7°
C7C8N2N32.0°0.2°
C8C7C6C90.6°0.1°
C7C8C10C11176.8°180.0°
C7C8C10C154.6°0.3°
C8N2N3C90.5°0.0°
N2C8C10C113.1°0.3°
N2C8C10C15169.1°180.0°
N2C8C7H12178.0°179.8°
N2N3C9C60.9°0.2°
N2N3C9N4178.5°180.0°
N3N2C8C10175.7°179.9°
N3C9C6N4179.3°179.8°
N3C9N4H140.0°0.0°
N3C9N4H13120.0°180.0°
C9C6C7H12179.4°180.0°
C6C9N4H14179.4°179.8°
C6C9N4H1359.4°0.2°
C9N4H14H13120.0°180.0°
C8C10C11C15172.3°179.7°
C8C10C11O8.2°0.0°
C8C10C11C12176.0°179.7°
C8C10C15C14177.6°179.7°
C8C10C15H192.4°0.1°
C10C8C7H124.6°0.1°
C10C11OC12176.0°179.7°
C10C11C12C131.9°0.3°
C11C10C15C145.1°0.6°
C10C11OH15180.0°90.3°
C10C11C12H16178.1°179.8°
C11C10C15H19174.9°179.7°
OC11C12C13178.0°180.0°
OC11C10C15179.5°179.7°
OC11C12H162.0°0.1°
C11C12C13H16180.0°179.9°
C11C12C13C141.4°0.0°
C12C11C10C153.7°0.5°
C12C11OH154.0°90.0°
C11C12C13H17178.6°179.9°
C12C13C14H17180.0°179.9°
C12C13C14C152.8°0.0°
C12C13C14H18177.2°180.0°
C13C14C15H18180.0°180.0°
C13C14C15C104.7°0.3°
C14C13C12H16178.6°179.9°
C13C14C15H19175.3°179.9°
C14C15C10H19180.0°179.8°
C15C14C13H17177.2°179.9°
C10C15C14H18175.3°179.8°
NC16C17C23171.3°179.8°
NC16C17C18175.5°179.8°
NC16C23C19174.8°180.0°
C16NCH19.2°46.1°
C16NC3H214.4°46.5°
NC16C23H295.2°0.0°
NC16C17H204.5°0.1°
C16C17C18H20180.0°179.9°
C16C17C18N52.5°0.4°
C17C16C23C193.5°0.2°
C17C16C23H29176.5°179.8°
C16C17C18H21177.5°179.8°
C17C18N5H21180.0°179.8°
C17C18N5C190.2°0.2°
C18C17C16C234.2°0.4°
C18N5C19O1179.7°180.0°
C18N5C19C231.0°0.1°
N5C18C17H20177.5°179.7°
N5C19O1C23179.4°179.9°
N5C19O1C2073.7°0.0°
N5C19C23C160.9°0.1°
N5C19C23H29179.1°179.9°
C19N5C18H21179.9°180.0°
C19O1C20C21128.5°180.0°
O1C19C23C16178.5°180.0°
O1C19C23H291.5°0.0°
C19O1C20H22111.4°60.0°
C19O1C20H238.5°60.0°
O1C20C21H22120.1°119.9°
O1C20C21H23120.1°120.0°
O1C20C21O284.6°64.9°
C20O1C19C23106.8°180.0°
O1C20H22H23119.8°120.0°
O1C20C21H2536.2°175.0°
O1C20C21H24154.7°55.0°
C20C21O2H25120.7°120.0°
C20C21O2H24120.7°120.0°
C20C21O2C22126.5°180.0°
C21C20H22H23119.8°120.1°
C20C21H25H24117.8°120.0°
O2C21C20H22155.4°55.0°
O2C21C20H2335.5°175.1°
O2C21H25H24117.8°120.0°
C21O2C22H26180.0°60.1°
C21O2C22H2860.0°180.0°
C21O2C22H2760.0°60.0°
C22O2C21H25112.7°60.0°
C22O2C21H245.8°60.0°
O2C22H26H28120.0°120.0°
O2C22H26H27120.0°120.1°
O2C22H28H27120.0°120.0°
C19C23C16H29180.0°180.0°
C23C16C17H20175.7°179.7°
H16C12C13H171.4°0.0°
H17C13C14H182.8°0.1°
H18C14C15H194.7°0.0°
H11C5CH156.3°52.0°
H10C5CH163.4°68.2°
H1CC1H495.9°92.6°
H1CC1H525.2°29.7°
H9C4C3H258.0°67.6°
H8C4C3H261.4°52.7°
H2C3C2H792.6°29.8°
H2C3C2H628.5°92.6°
H7C2C1H41.8°122.6°
H7C2C1H5119.3°0.3°
H6C2C1H4123.0°0.2°
H6C2C1H51.8°122.5°
H21C18C17H202.5°0.1°
H22C20C21H2583.9°65.0°
H22C20C21H2434.6°175.0°
H23C20C21H25156.3°55.0°
H23C20C21H2485.2°65.0°
H26C22H28H27120.0°119.9°

225946

PDB entries from 2024-10-09

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