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SR5

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
CLC22sing1.74Å1.74Å
C23C22doub1.36Å1.37ÅAromatic
C23C24sing1.41Å1.41ÅAromatic
C22C21sing1.39Å1.38ÅAromatic
N3C24doub1.34Å1.37ÅAromatic
N3C25sing1.31Å1.32ÅAromatic
C24C19sing1.42Å1.42ÅAromatic
C21C20doub1.36Å1.36ÅAromatic
C25C26doub1.39Å1.38ÅAromatic
C19C20sing1.40Å1.42ÅAromatic
C19C18doub1.41Å1.43ÅAromatic
C26C18sing1.38Å1.38ÅAromatic
C18N2sing1.39Å1.43Å
N2N1sing1.40Å1.37ÅAromatic
N2C8sing1.37Å1.37ÅAromatic
N1C7doub1.32Å1.34ÅAromatic
C11O3sing1.43Å1.43Å
O3C10sing1.36Å1.37Å
OCdoub1.22Å1.23Å
C10C12doub1.38Å1.39ÅAromatic
C10C9sing1.40Å1.41ÅAromatic
C8C9sing1.48Å1.48Å
C8C17doub1.36Å1.38ÅAromatic
C7Csing1.48Å1.48Å
C7C17sing1.41Å1.40ÅAromatic
C12C13sing1.38Å1.38ÅAromatic
C9C15doub1.40Å1.41ÅAromatic
CNsing1.35Å1.34Å
C13C14doub1.38Å1.38ÅAromatic
C15C14sing1.39Å1.39ÅAromatic
C15O4sing1.36Å1.37Å
O4C16sing1.43Å1.43Å
O1C6sing1.34Å1.31Å
NC1sing1.47Å1.45Å
C6O2doub1.21Å1.22Å
C6C1sing1.51Å1.52Å
C1C2sing1.53Å1.53Å
C2C3sing1.53Å1.53Å
C4C3sing1.53Å1.52Å
C3C5sing1.53Å1.52Å
C21H23sing1.08Å1.08Å
C20H22sing1.08Å1.08Å
C23H24sing1.08Å1.08Å
C25H25sing1.08Å1.08Å
C26H26sing1.08Å1.08Å
C16H18sing1.09Å1.10Å
C16H20sing1.09Å1.10Å
C16H19sing1.09Å1.10Å
C14H17sing1.08Å1.08Å
C13H16sing1.08Å1.08Å
C12H15sing1.08Å1.08Å
C11H12sing1.09Å1.10Å
C11H14sing1.09Å1.10Å
C11H13sing1.09Å1.10Å
C17H21sing1.08Å1.08Å
NH1sing0.97Å1.00Å
C1Hsing1.09Å1.10Å
O1H11sing0.97Å0.95Å
C2H2sing1.09Å1.10Å
C2H3sing1.09Å1.10Å
C3H4sing1.09Å1.10Å
C5H9sing1.09Å1.10Å
C5H8sing1.09Å1.10Å
C5H10sing1.09Å1.10Å
C4H5sing1.09Å1.10Å
C4H7sing1.09Å1.10Å
C4H6sing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
CLC22C23119.1°119.5°
CLC22C21118.8°119.5°
C22C23C24119.4°119.7°
C23C22C21122.2°121.1°
C22C23H24120.3°120.1°
C23C24N3118.1°121.0°
C23C24C19119.3°119.1°
C24C23H24120.3°120.1°
C22C21C20119.7°120.8°
C22C21H23120.1°119.7°
C24N3C25117.3°121.7°
N3C24C19122.5°119.9°
N3C25C26124.8°121.9°
N3C25H25117.6°119.0°
C24C19C20118.3°119.7°
C24C19C18117.3°118.9°
C21C20C19121.1°119.7°
C20C21H23120.2°119.6°
C21C20H22119.5°120.1°
C25C26C18119.2°119.7°
C26C25H25117.6°119.1°
C25C26H26120.4°120.2°
C20C19C18124.5°121.4°
C19C20H22119.4°120.2°
C19C18C26118.9°117.9°
C19C18N2122.0°121.0°
C26C18N2118.9°121.0°
C18C26H26120.4°120.2°
C18N2N1116.6°126.0°
C18N2C8131.1°126.1°
N1N2C8112.2°107.9°
N2N1C7104.1°108.4°
N2C8C9122.7°126.2°
N2C8C17106.2°107.6°
N1C7C119.1°125.8°
N1C7C17112.0°108.3°
C11O3C10118.2°117.0°
O3C11H12109.5°109.5°
O3C11H14109.5°109.5°
O3C11H13109.5°109.5°
O3C10C12124.5°120.1°
O3C10C9115.1°120.0°
OCC7121.1°120.0°
OCN122.9°120.0°
C12C10C9120.4°119.8°
C10C12C13119.8°120.2°
C10C12H15120.1°119.9°
C10C9C8120.1°120.2°
C10C9C15118.5°119.6°
C9C8C17131.1°126.2°
C8C9C15121.4°120.2°
C8C17C7105.5°107.8°
C8C17H21127.3°126.0°
CC7C17128.9°125.9°
C7CN115.9°120.0°
C7C17H21127.2°126.1°
C12C13C14120.9°120.4°
C12C13H16119.5°119.8°
C13C12H15120.1°119.9°
C9C15C14120.6°119.8°
C9C15O4115.6°120.1°
CNC1120.4°120.0°
CNH1119.8°120.1°
C13C14C15119.7°120.2°
C13C14H17120.2°119.9°
C14C13H16119.5°119.8°
C14C15O4123.9°120.1°
C15C14H17120.2°119.9°
C15O4C16117.8°117.0°
O4C16H18109.5°109.5°
O4C16H20109.5°109.5°
O4C16H19109.4°109.5°
O1C6O2124.1°120.0°
O1C6C1112.5°120.0°
C6O1H11109.5°117.0°
NC1C6111.3°109.4°
NC1C2110.9°109.5°
C1NH1119.8°120.0°
NC1H108.3°109.5°
O2C6C1123.3°120.0°
C6C1C2111.2°109.5°
C6C1H107.5°109.5°
C1C2C3114.8°109.5°
C2C1H107.4°109.5°
C1C2H2108.1°109.5°
C1C2H3108.1°109.4°
C2C3C4110.5°109.5°
C2C3C5111.5°109.5°
C3C2H2108.1°109.5°
C3C2H3108.1°109.5°
C2C3H4107.9°109.5°
C4C3C5111.0°109.5°
C4C3H4107.9°109.4°
C3C4H5109.5°109.5°
C3C4H7109.4°109.4°
C3C4H6109.5°109.5°
C5C3H4107.9°109.5°
C3C5H9109.5°109.4°
C3C5H8109.5°109.5°
C3C5H10109.5°109.5°
H18C16H20109.5°109.4°
H18C16H19109.5°109.5°
H20C16H19109.5°109.4°
H12C11H14109.5°109.5°
H12C11H13109.5°109.4°
H14C11H13109.4°109.5°
H2C2H3109.5°109.5°
H9C5H8109.5°109.5°
H9C5H10109.4°109.5°
H8C5H10109.5°109.5°
H5C4H7109.4°109.5°
H5C4H6109.5°109.5°
H7C4H6109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
CLC22C23C21179.5°179.8°
CLC22C23C24179.2°180.0°
CLC22C21C20179.6°179.9°
CLC22C21H230.4°0.0°
CLC22C23H240.8°0.1°
C22C23C24H24180.0°179.9°
C22C23C24N3178.9°180.0°
C22C23C24C190.5°0.1°
C23C22C21C200.1°0.3°
C23C22C21H23179.8°179.8°
C24C23C22C210.2°0.2°
C23C24N3C19179.4°179.9°
C23C24N3C25179.2°180.0°
C23C24C19C200.4°0.3°
C23C24C19C18180.0°180.0°
C22C21C20H23180.0°180.0°
C22C21C20C190.3°0.1°
C22C21C20H22179.7°180.0°
C21C22C23H24179.8°179.7°
C24N3C25C260.4°0.0°
N3C24C19C20179.0°179.8°
N3C24C19C180.7°0.0°
N3C24C23H241.1°0.1°
C24N3C25H25179.6°180.0°
C25N3C24C190.2°0.0°
N3C25C26H25180.0°180.0°
N3C25C26C180.1°0.1°
N3C25C26H26179.9°179.9°
C24C19C20C210.0°0.2°
C24C19C20C18179.7°179.7°
C24C19C18C261.2°0.0°
C24C19C18N2174.4°180.0°
C24C19C20H22180.0°179.7°
C19C24C23H24179.5°180.0°
C21C20C19H22180.0°179.9°
C21C20C19C18179.6°180.0°
C25C26C18C191.0°0.1°
C25C26C18H26180.0°179.9°
C25C26C18N2174.7°180.0°
C20C19C18C26178.5°179.7°
C20C19C18N26.0°0.2°
C19C20C21H23179.7°180.0°
C19C18C26N2175.7°179.9°
C19C18N2N156.8°49.3°
C19C18N2C8120.6°130.4°
C18C19C20H220.4°0.0°
C19C18C26H26179.0°179.9°
C26C18N2N1118.7°130.8°
C26C18N2C863.8°49.5°
C18C26C25H25179.9°180.0°
C18N2N1C8177.9°179.7°
C18N2N1C7177.1°180.0°
C18N2C8C93.3°0.0°
C18N2C8C17176.9°180.0°
N2C18C26H265.3°0.1°
N1N2C8C9179.2°179.8°
N1N2C8C170.6°0.2°
N2N1C7C177.7°180.0°
N2N1C7C170.7°0.1°
C8N2N1C70.8°0.2°
N2C8C9C1079.3°51.1°
N2C8C9C17179.7°180.0°
N2C8C17C70.2°0.1°
N2C8C9C15100.3°129.1°
N2C8C17H21179.8°180.0°
N1C7CO2.4°180.0°
N1C7C17C80.3°0.0°
N1C7CC17178.1°179.9°
N1C7CN176.4°0.1°
N1C7C17H21179.7°179.9°
C11O3C10C129.1°5.2°
C11O3C10C9170.9°175.3°
O3C11H12H14120.0°120.0°
O3C11H12H13120.0°120.0°
O3C11H14H13120.0°120.0°
O3C10C12C9180.0°179.4°
O3C10C9C80.3°0.3°
O3C10C12C13179.2°180.0°
O3C10C9C15179.9°180.0°
O3C10C12H150.8°0.3°
C10O3C11H12180.0°55.1°
C10O3C11H1460.0°175.1°
C10O3C11H1360.0°64.9°
OCC7N178.8°179.9°
OCC7C17179.5°0.1°
OCNC13.7°0.1°
OCNH1176.4°180.0°
C12C10C9C8179.7°179.7°
C10C12C13H15180.0°179.7°
C12C10C9C150.1°0.5°
C10C12C13C140.5°0.3°
C10C12C13H16179.5°179.7°
C10C9C8C15179.6°179.8°
C10C9C8C17101.0°128.8°
C9C10C12C130.8°0.6°
C10C9C15C140.9°0.2°
C10C9C15O4178.5°179.7°
C9C10C12H15179.2°179.8°
C9C8C17C7179.6°179.8°
C8C9C15C14178.7°180.0°
C8C9C15O41.9°0.0°
C9C8C17H210.4°0.0°
C8C17C7C177.9°179.9°
C8C17C7H21180.0°179.9°
C17C8C9C1579.4°50.9°
C7CNC1177.6°180.0°
CC7C17H212.1°0.0°
C7CNH12.4°0.0°
C17C7CN1.7°179.8°
C12C13C14H16180.0°180.0°
C12C13C14C150.5°0.0°
C12C13C14H17179.6°180.0°
C9C15C14C131.2°0.1°
C9C15C14O4179.4°179.9°
C9C15O4C16142.8°180.0°
C9C15C14H17178.8°180.0°
CNC1H1180.0°180.0°
CNC1C680.4°85.0°
CNC1C2155.3°155.0°
CNC1H37.6°34.9°
C13C14C15H17180.0°180.0°
C13C14C15O4178.2°180.0°
C14C13C12H15179.5°180.0°
C14C15O4C1636.6°0.1°
C15C14C13H16179.6°180.0°
C15O4C16H18180.0°180.0°
C15O4C16H2060.0°60.0°
C15O4C16H1960.0°60.0°
O4C15C14H171.8°0.1°
O4C16H18H20120.0°120.0°
O4C16H18H19120.0°120.1°
O4C16H20H19120.0°120.0°
O1C6C1N136.1°180.0°
O1C6O2C1179.0°179.9°
O1C6C1C299.7°60.0°
O1C6C1H17.6°60.1°
NC1C6O243.0°0.1°
NC1C6C2124.2°120.0°
NC1C6H118.5°120.0°
NC1C2H118.2°120.0°
NC1C2C3156.3°63.3°
NC1C2H235.5°56.7°
NC1C2H382.9°176.7°
O2C6C1C281.2°119.9°
O2C6C1H161.5°120.0°
O2C6O1H110.0°0.0°
C6C1C2H117.3°120.0°
C6C1C2C379.2°176.7°
C6C1NH199.7°95.0°
C1C6O1H11179.1°179.9°
C6C1C2H2160.0°63.3°
C6C1C2H341.5°56.7°
C1C2C3H2120.8°120.0°
C1C2C3H3120.8°119.9°
C1C2C3C474.9°65.3°
C1C2C3C5161.1°174.7°
C2C1NH124.7°25.0°
C1C2H2H3117.6°119.9°
C1C2C3H442.8°54.7°
C2C3C4C5124.3°120.0°
C2C3C4H4117.7°120.0°
C2C3C5H4118.3°120.0°
C3C2C1H38.1°56.7°
C3C2H2H3117.6°120.0°
C2C3C5H9180.0°64.9°
C2C3C5H860.0°175.1°
C2C3C5H1060.0°55.1°
C2C3C4H5180.0°60.0°
C2C3C4H760.0°180.0°
C2C3C4H660.0°60.0°
C4C3C5H4118.0°120.0°
C4C3C2H245.9°174.7°
C4C3C2H3164.3°54.7°
C4C3C5H956.3°55.1°
C4C3C5H863.7°64.9°
C4C3C5H10176.3°175.0°
C3C4H5H7120.0°120.0°
C3C4H5H6120.0°120.0°
C3C4H7H6120.0°120.0°
C5C3C2H278.1°54.7°
C5C3C2H340.3°65.3°
C3C5H9H8120.0°120.0°
C3C5H9H10120.0°120.0°
C3C5H8H10120.0°120.0°
C5C3C4H555.7°180.0°
C5C3C4H7175.7°60.0°
C5C3C4H664.3°60.0°
H23C21C20H220.3°0.0°
H25C25C26H260.2°0.1°
H18C16H20H19120.0°120.0°
H17C14C13H160.4°0.0°
H16C13C12H150.5°0.0°
H12C11H14H13120.0°120.0°
H1NC1H142.4°145.0°
HC1C2H282.7°176.7°
HC1C2H3158.9°63.3°
H2C2C3H4163.6°65.3°
H3C2C3H478.0°174.6°
H4C3C5H961.7°175.1°
H4C3C5H8178.3°55.1°
H4C3C5H1058.3°65.0°
H4C3C4H562.3°60.0°
H4C3C4H757.7°60.0°
H4C3C4H6177.7°180.0°
H9C5H8H10119.9°120.0°
H5C4H7H6120.0°120.0°

223532

PDB entries from 2024-08-07

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