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LBE

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C23C24doub1.38Å1.38ÅAromatic
C23C22sing1.38Å1.38ÅAromatic
C24C25sing1.38Å1.39ÅAromatic
C22C21doub1.38Å1.39ÅAromatic
C25C20doub1.39Å1.39ÅAromatic
C21C20sing1.39Å1.39ÅAromatic
C20N3sing1.40Å1.43Å
N2C19sing1.38Å1.33Å
N3C19sing1.35Å1.36ÅAromatic
N3N4sing1.40Å1.38ÅAromatic
C19C18doub1.39Å1.39ÅAromatic
N4C26doub1.30Å1.33ÅAromatic
C18C26sing1.41Å1.41ÅAromatic
C18Csing1.47Å1.46Å
OCdoub1.22Å1.24Å
CNsing1.35Å1.33Å
NC1sing1.46Å1.45Å
C1C2sing1.51Å1.51Å
C17C2doub1.38Å1.39ÅAromatic
C17C16sing1.38Å1.38ÅAromatic
C2C3sing1.38Å1.38ÅAromatic
C16C5doub1.40Å1.38ÅAromatic
C3C4doub1.38Å1.39ÅAromatic
C5C4sing1.39Å1.38ÅAromatic
C5C6sing1.48Å1.49Å
O1C6doub1.22Å1.23Å
C6N1sing1.35Å1.33Å
N1C7sing1.47Å1.45Å
C7C8sing1.53Å1.53Å
C14C15sing1.53Å1.52Å
C14C13sing1.53Å1.50Å
C15C10sing1.53Å1.53Å
C8C9sing1.53Å1.45Å
C10C9sing1.53Å1.49Å
C10C11sing1.53Å1.52Å
C13C12sing1.53Å1.50Å
C12C11sing1.53Å1.52Å
C1H1sing1.09Å1.10Å
C1H2sing1.09Å1.10Å
C3H3sing1.08Å1.08Å
C4H4sing1.08Å1.08Å
C7H5sing1.09Å1.10Å
C7H6sing1.09Å1.10Å
C8H7sing1.09Å1.10Å
C8H8sing1.09Å1.10Å
C9H9sing1.09Å1.10Å
C9H10sing1.09Å1.10Å
C10H11sing1.09Å1.10Å
C12H12sing1.09Å1.10Å
C12H13sing1.09Å1.10Å
C15H14sing1.09Å1.10Å
C15H15sing1.09Å1.10Å
C16H16sing1.08Å1.08Å
C17H17sing1.08Å1.08Å
C21H18sing1.08Å1.08Å
C22H19sing1.08Å1.08Å
C23H20sing1.08Å1.08Å
C24H21sing1.08Å1.08Å
C25H22sing1.08Å1.08Å
C26H23sing1.08Å1.08Å
N1H24sing0.97Å1.00Å
C14H25sing1.09Å1.10Å
C14H26sing1.09Å1.10Å
C13H27sing1.09Å1.10Å
C13H28sing1.09Å1.10Å
C11H29sing1.09Å1.10Å
C11H30sing1.09Å1.10Å
NH31sing0.97Å1.00Å
N2H32sing0.97Å1.00Å
N2H33sing0.97Å1.00Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C24C23C22120.0°120.1°
C23C24C25120.4°120.1°
C24C23H20120.0°119.9°
C23C24H21119.8°120.0°
C23C22C21120.4°120.1°
C23C22H19119.8°119.9°
C22C23H20120.0°120.0°
C24C25C20119.6°119.9°
C25C24H21119.8°120.0°
C24C25H22120.2°120.1°
C22C21C20119.6°119.9°
C22C21H18120.2°120.0°
C21C22H19119.8°120.0°
C25C20C21120.0°119.9°
C25C20N3120.1°120.1°
C20C25H22120.2°120.0°
C21C20N3119.8°120.1°
C20C21H18120.2°120.1°
C20N3C19128.9°125.8°
C20N3N4118.8°125.8°
N2C19N3124.0°126.5°
N2C19C18129.6°126.5°
C19N2H32109.5°120.0°
C19N2H33109.5°120.1°
C19N3N4112.0°108.5°
N3C19C18106.4°107.0°
N3N4C26104.6°109.2°
C19C18C26105.0°107.0°
C19C18C123.1°126.5°
N4C26C18112.0°108.3°
N4C26H23124.0°125.9°
C26C18C131.6°126.6°
C18C26H23124.0°125.9°
C18CO121.1°120.0°
C18CN115.7°120.0°
OCN123.2°120.0°
CNC1121.4°120.0°
CNH31119.3°120.0°
NC1C2112.0°109.5°
NC1H1108.8°109.4°
NC1H2108.8°109.5°
C1NH31119.3°120.0°
C1C2C17121.0°119.8°
C1C2C3120.8°119.9°
C2C1H1108.9°109.5°
C2C1H2108.8°109.5°
C2C17C16120.9°120.1°
C17C2C3118.2°120.3°
C2C17H17119.5°119.9°
C17C16C5120.8°119.9°
C17C16H16119.6°120.1°
C16C17H17119.5°119.9°
C2C3C4120.9°120.1°
C2C3H3119.5°119.9°
C16C5C4118.4°119.7°
C16C5C6117.5°120.1°
C5C16H16119.6°120.1°
C3C4C5120.7°119.9°
C4C3H3119.5°120.0°
C3C4H4119.6°120.0°
C4C5C6123.9°120.2°
C5C4H4119.7°120.1°
C5C6O1120.3°120.0°
C5C6N1117.1°120.0°
O1C6N1122.6°120.0°
C6N1C7122.4°120.0°
C6N1H24118.8°120.1°
N1C7C8106.6°109.4°
N1C7H5110.2°109.5°
N1C7H6110.2°109.5°
C7N1H24118.8°120.0°
C7C8C9114.7°109.4°
C8C7H5110.2°109.5°
C8C7H6110.2°109.4°
C7C8H7108.2°109.4°
C7C8H8108.2°109.5°
C15C14C13111.5°109.5°
C14C15C10111.4°109.5°
C14C15H14109.0°109.5°
C14C15H15109.0°109.5°
C15C14H25109.0°109.5°
C15C14H26108.9°109.5°
C14C13C12110.6°109.4°
C13C14H25109.0°109.5°
C13C14H26109.0°109.4°
C14C13H27109.2°109.5°
C14C13H28109.2°109.5°
C15C10C9112.2°109.5°
C15C10C11110.2°109.4°
C15C10H11108.3°109.5°
C10C15H14109.0°109.4°
C10C15H15109.0°109.5°
C8C9C10116.5°109.4°
C9C8H7108.1°109.5°
C9C8H8108.1°109.5°
C8C9H9107.7°109.5°
C8C9H10107.7°109.5°
C9C10C11108.5°109.5°
C10C9H9107.7°109.5°
C10C9H10107.7°109.5°
C9C10H11108.9°109.5°
C10C11C12112.9°109.5°
C11C10H11108.6°109.5°
C10C11H29108.6°109.5°
C10C11H30108.6°109.4°
C13C12C11111.0°109.5°
C13C12H12109.1°109.5°
C13C12H13109.1°109.4°
C12C13H27109.2°109.5°
C12C13H28109.2°109.5°
C11C12H12109.1°109.5°
C11C12H13109.1°109.5°
C12C11H29108.6°109.5°
C12C11H30108.6°109.5°
H1C1H2109.5°109.5°
H5C7H6109.5°109.5°
H7C8H8109.5°109.5°
H9C9H10109.5°109.5°
H12C12H13109.5°109.5°
H14C15H15109.5°109.5°
H25C14H26109.5°109.5°
H27C13H28109.5°109.5°
H29C11H30109.5°109.5°
H32N2H33109.5°119.9°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C24C23C22H20180.0°179.9°
C23C24C25H21180.0°179.9°
C24C23C22C210.2°0.0°
C23C24C25C200.0°0.1°
C24C23C22H19179.8°179.9°
C23C24C25H22179.9°180.0°
C22C23C24C250.1°0.1°
C23C22C21H19180.0°179.9°
C23C22C21C200.2°0.0°
C23C22C21H18179.8°179.7°
C22C23C24H21179.9°180.0°
C24C25C20H22180.0°179.9°
C24C25C20C210.1°0.0°
C24C25C20N3178.0°179.8°
C25C24C23H20179.9°180.0°
C22C21C20C250.2°0.0°
C22C21C20H18180.0°179.7°
C22C21C20N3177.9°179.7°
C21C22C23H20179.8°179.9°
C25C20C21N3178.1°179.7°
C25C20N3C1983.5°35.3°
C25C20N3N4103.2°144.7°
C25C20C21H18179.8°179.7°
C20C25C24H21180.0°180.0°
C21C20N3C1994.5°145.0°
C21C20N3N478.7°35.0°
C20C21C22H19179.8°180.0°
C21C20C25H22179.9°179.9°
C20N3C19N28.3°0.1°
C20N3C19N4173.6°180.0°
C20N3C19C18171.7°180.0°
C20N3N4C26173.1°179.8°
N3C20C21H182.1°0.1°
N3C20C25H222.0°0.3°
N2C19N3C18180.0°180.0°
N2C19N3N4178.1°179.9°
N2C19C18C26178.3°179.8°
N2C19C18C6.8°0.2°
C19N2H32H33120.0°180.0°
C19N3N4C261.3°0.2°
N3C19C18C261.8°0.2°
N3C19C18C173.1°179.8°
N3C19N2H32180.0°0.0°
N3C19N2H3360.0°180.0°
N4N3C19C181.9°0.0°
N3N4C26C180.1°0.3°
N3N4C26H23179.9°179.9°
C19C18C26N41.1°0.3°
C19C18C26C174.3°180.0°
C19C18CO2.5°0.0°
C19C18CN178.1°180.0°
C19C18C26H23178.9°179.9°
C18C19N2H320.0°180.0°
C18C19N2H33120.0°0.1°
N4C26C18H23180.0°179.6°
N4C26C18C173.2°179.7°
C26C18CO170.9°180.0°
C26C18CN8.5°0.0°
C18CON179.3°180.0°
C18CNC1177.2°180.0°
CC18C26H236.8°0.1°
C18CNH312.8°0.0°
OCNC12.2°0.1°
OCNH31177.8°179.9°
CNC1H31180.0°180.0°
CNC1C287.5°180.0°
CNC1H1152.1°60.0°
CNC1H232.8°59.9°
NC1C2H1120.4°120.0°
NC1C2H2120.4°120.0°
NC1C2C1710.3°90.3°
NC1C2C3170.7°90.0°
NC1H1H2118.8°120.0°
C1C2C17C3179.0°179.7°
C1C2C17C16179.5°179.7°
C1C2C3C4178.7°180.0°
C2C1H1H2118.9°120.0°
C1C2C3H31.3°0.0°
C1C2C17H170.5°0.0°
C2C1NH3192.4°0.0°
C2C17C16H17180.0°179.7°
C2C17C16C50.4°0.6°
C17C2C3C40.3°0.3°
C17C2C1H1130.7°29.7°
C17C2C1H2110.0°149.7°
C17C2C3H3179.7°179.7°
C2C17C16H16179.6°179.7°
C16C17C2C30.5°0.6°
C17C16C5H16180.0°179.8°
C17C16C5C42.0°0.3°
C17C16C5C6173.2°179.7°
C2C3C4H3180.0°180.0°
C2C3C4C52.0°0.0°
C3C2C1H150.3°150.0°
C3C2C1H269.0°30.0°
C2C3C4H4178.0°180.0°
C3C2C17H17179.5°179.8°
C16C5C4C32.8°0.0°
C16C5C4C6174.8°180.0°
C16C5C6O114.6°179.9°
C16C5C6N1163.8°0.0°
C16C5C4H4177.2°180.0°
C5C16C17H17179.6°179.8°
C3C4C5H4180.0°180.0°
C3C4C5C6172.0°180.0°
C4C5C6O1160.3°0.1°
C4C5C6N121.4°180.0°
C5C4C3H3178.0°180.0°
C4C5C16H16178.0°180.0°
C5C6O1N1178.2°179.9°
C5C6N1C7171.8°180.0°
C6C5C4H47.9°0.0°
C6C5C16H166.8°0.0°
C5C6N1H248.2°0.0°
O1C6N1C79.9°0.0°
O1C6N1H24170.0°179.9°
C6N1C7H24180.0°180.0°
C6N1C7C871.4°180.0°
C6N1C7H5169.1°60.0°
C6N1C7H648.2°60.0°
N1C7C8H5119.5°120.0°
N1C7C8H6119.5°120.0°
N1C7C8C9167.2°180.0°
N1C7H5H6121.3°120.0°
N1C7C8H746.4°60.0°
N1C7C8H872.1°60.0°
C7C8C9H7120.8°119.9°
C7C8C9H8120.8°120.0°
C7C8C9C1064.6°180.0°
C8C7H5H6121.4°120.0°
C7C8H7H8117.7°120.0°
C7C8C9H9174.4°60.0°
C7C8C9H1056.4°60.0°
C8C7N1H24108.7°0.0°
C15C14C13H25120.3°120.0°
C15C14C13H26120.3°120.0°
C14C15C10H14120.3°120.0°
C14C15C10H15120.3°120.0°
C14C15C10C9173.8°180.0°
C14C15C10C1152.7°60.0°
C15C14C13C1257.8°60.0°
C14C15C10H1165.9°60.0°
C14C15H14H15119.1°120.0°
C15C14H25H26119.0°120.0°
C15C14C13H27178.0°60.0°
C15C14C13H2862.3°180.0°
C13C14C15C1056.1°60.1°
C14C13C12H27120.1°120.0°
C14C13C12H28120.2°120.0°
C14C13C12C1156.8°60.0°
C14C13C12H1263.5°60.0°
C14C13C12H13177.0°180.0°
C13C14C15H1464.2°180.0°
C13C14C15H15176.4°60.0°
C13C14H25H26119.1°120.0°
C14C13H27H28119.5°120.0°
C15C10C9C869.9°65.0°
C15C10C9C11122.1°119.9°
C15C10C9H11119.9°120.0°
C15C10C11H11118.5°120.0°
C15C10C11C1252.8°60.0°
C15C10C9H951.1°55.0°
C15C10C9H10169.1°175.0°
C10C15H14H15119.1°120.0°
C10C15C14H2564.2°60.0°
C10C15C14H26176.4°180.0°
C15C10C11H2967.7°60.0°
C15C10C11H30173.3°180.0°
C8C9C10H9121.0°120.0°
C8C9C10H10121.0°119.9°
C8C9C10C11168.1°175.0°
C9C8C7H573.3°60.0°
C9C8C7H647.6°60.0°
C9C8H7H8117.6°120.1°
C8C9H9H10116.8°120.0°
C8C9C10H1150.0°55.0°
C9C10C11H11118.2°120.0°
C9C10C11C12176.1°180.0°
C10C9C8H756.1°60.0°
C10C9C8H8174.6°60.1°
C10C9H9H10116.8°120.0°
C9C10C15H1453.5°60.0°
C9C10C15H1565.9°60.0°
C9C10C11H2955.6°60.0°
C9C10C11H3063.4°60.0°
C10C11C12C1355.3°60.1°
C10C11C12H29120.5°120.0°
C10C11C12H30120.5°120.0°
C11C10C9H970.9°64.9°
C11C10C9H1047.0°55.1°
C10C11C12H1264.9°60.0°
C10C11C12H13175.6°180.0°
C11C10C15H1467.6°180.0°
C11C10C15H15173.0°60.0°
C10C11H29H30118.4°120.0°
C13C12C11H12120.2°120.0°
C13C12C11H13120.3°120.0°
C13C12H12H13119.3°120.0°
C12C13C14H2562.5°60.0°
C12C13C14H26178.1°180.0°
C12C13H27H28119.5°120.0°
C13C12C11H2965.2°60.0°
C13C12C11H30175.8°180.0°
C12C11C10H1165.7°60.0°
C11C12H12H13119.3°120.0°
C11C12C13H27176.9°60.0°
C11C12C13H2863.4°180.0°
C12C11H29H30118.4°120.0°
H1C1NH3127.9°120.0°
H2C1NH31147.2°120.1°
H3C3C4H42.0°0.0°
H5C7C8H7166.0°60.0°
H5C7C8H847.4°180.0°
H5C7N1H2410.9°120.0°
H6C7C8H773.1°180.0°
H6C7C8H8168.4°60.0°
H6C7N1H24131.8°120.0°
H7C8C9H964.9°179.9°
H7C8C9H10177.2°59.9°
H8C8C9H953.6°60.0°
H8C8C9H1064.4°180.0°
H9C9C10H11171.1°175.0°
H10C9C10H1171.0°65.0°
H11C10C15H14173.8°60.0°
H11C10C15H1554.4°180.0°
H11C10C11H29173.8°180.0°
H11C10C11H3054.8°60.0°
H12C12C13H2756.7°180.0°
H12C12C13H28176.4°60.0°
H12C12C11H29174.6°180.0°
H12C12C11H3055.6°60.0°
H13C12C13H2762.9°60.0°
H13C12C13H2856.8°60.0°
H13C12C11H2955.1°60.0°
H13C12C11H3063.9°60.0°
H14C15C14H25175.5°60.0°
H14C15C14H2656.1°60.0°
H15C15C14H2556.1°180.0°
H15C15C14H2663.3°60.0°
H16C16C17H170.3°0.0°
H18C21C22H190.2°0.4°
H19C22C23H200.1°0.0°
H20C23C24H210.1°0.1°
H21C24C25H220.1°0.1°
H25C14C13H2757.7°180.0°
H25C14C13H28177.4°60.0°
H26C14C13H2761.7°60.0°
H26C14C13H2858.0°60.1°

222624

PDB entries from 2024-07-17

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