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A1E61

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
O33C32doub1.21Å1.26Å
C32O34sing1.34Å1.26Å
C32C31sing1.51Å1.53Å
C31C30sing1.53Å1.53Å
C30S29sing1.81Å1.83Å
C12C11doub1.38Å1.39ÅAromatic
C12C13sing1.38Å1.38ÅAromatic
C11C10sing1.38Å1.38ÅAromatic
O05C04doub1.21Å1.19Å
S08C09sing1.81Å1.83Å
S08C07sing1.81Å1.83Å
C01N02sing1.46Å1.46Å
C04N02sing1.35Å1.47Å
C04C06sing1.51Å1.54Å
C13C14doub1.40Å1.38ÅAromatic
S29C09sing1.81Å1.83Å
N02C03sing1.46Å1.46Å
C06C07sing1.53Å1.54Å
C10C09sing1.51Å1.55Å
C10C15doub1.38Å1.38ÅAromatic
C14C15sing1.40Å1.38ÅAromatic
C14C16sing1.47Å1.52Å
C16C17doub1.34Å1.33Å
C17C18sing1.47Å1.55Å
C28C18doub1.41Å1.39ÅAromatic
C28C27sing1.36Å1.40ÅAromatic
C18N19sing1.32Å1.32ÅAromatic
C27C21doub1.41Å1.41ÅAromatic
N19C20doub1.34Å1.34ÅAromatic
C20C21sing1.42Å1.37ÅAromatic
C20C25sing1.41Å1.41ÅAromatic
C21C22sing1.40Å1.41ÅAromatic
C25C24doub1.36Å1.39ÅAromatic
C22C23doub1.36Å1.39ÅAromatic
C24C23sing1.40Å1.39ÅAromatic
C24CL26sing1.74Å1.79Å
C13H1sing1.08Å1.08Å
C15H2sing1.08Å1.08Å
C17H3sing1.08Å1.08Å
C22H5sing1.08Å1.08Å
C28H6sing1.08Å1.08Å
C01H7sing1.09Å1.10Å
C01H9sing1.09Å1.10Å
C01H8sing1.09Å1.10Å
C03H12sing1.09Å1.10Å
C03H10sing1.09Å1.10Å
C03H11sing1.09Å1.10Å
C06H13sing1.09Å1.10Å
C06H14sing1.09Å1.10Å
C07H15sing1.09Å1.10Å
C07H16sing1.09Å1.10Å
C09H17sing1.09Å1.10Å
C11H18sing1.08Å1.08Å
C12H19sing1.08Å1.08Å
C16H20sing1.08Å1.08Å
C23H22sing1.08Å1.08Å
C25H23sing1.08Å1.08Å
C27H24sing1.08Å1.08Å
C30H25sing1.09Å1.10Å
C30H26sing1.09Å1.10Å
C31H28sing1.09Å1.10Å
C31H27sing1.09Å1.10Å
O34H4sing0.97Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
O33C32O34120.3°120.0°
O33C32C31119.9°120.0°
O34C32C31119.8°120.0°
C32O34H4109.5°117.0°
C32C31C30111.1°109.5°
C32C31H28109.0°109.4°
C32C31H27109.0°109.5°
C31C30S29108.9°109.5°
C31C30H25109.6°109.4°
C31C30H26109.6°109.4°
C30C31H28109.0°109.4°
C30C31H27109.1°109.5°
C30S29C09109.7°103.0°
S29C30H25109.6°109.5°
S29C30H26109.6°109.5°
C11C12C13119.9°120.2°
C12C11C10119.7°120.3°
C12C11H18120.2°119.9°
C11C12H19120.0°119.9°
C12C13C14120.1°119.8°
C12C13H1119.9°120.1°
C13C12H19120.0°119.9°
C11C10C09121.4°119.9°
C11C10C15120.3°120.1°
C10C11H18120.2°119.8°
O05C04N02117.9°120.0°
O05C04C06119.2°120.0°
C09S08C07111.3°103.0°
S08C09S29109.4°109.4°
S08C09C10111.2°109.5°
S08C09H17108.5°109.5°
S08C07C06107.0°109.5°
S08C07H15110.1°109.5°
S08C07H16110.1°109.5°
C01N02C04118.8°120.0°
C01N02C03117.5°120.0°
N02C01H7109.5°109.4°
N02C01H9109.5°109.4°
N02C01H8109.5°109.5°
N02C04C06122.8°120.0°
C04N02C03123.7°120.0°
C04C06C07114.6°109.5°
C04C06H13108.2°109.5°
C04C06H14108.1°109.5°
C13C14C15120.2°119.7°
C13C14C16120.7°120.1°
C14C13H1120.0°120.1°
S29C09C10107.1°109.5°
S29C09H17108.5°109.5°
N02C03H12109.5°109.5°
N02C03H10109.5°109.5°
N02C03H11109.5°109.5°
C07C06H13108.2°109.4°
C07C06H14108.2°109.5°
C06C07H15110.1°109.4°
C06C07H16110.1°109.5°
C09C10C15118.3°119.9°
C10C09H17112.0°109.5°
C10C15C14119.8°119.8°
C10C15H2120.1°120.0°
C15C14C16119.1°120.2°
C14C15H2120.1°120.1°
C14C16C17124.2°120.0°
C14C16H20117.9°119.9°
C16C17C18124.9°120.0°
C16C17H3117.5°120.0°
C17C16H20117.9°120.0°
C17C18C28119.7°119.3°
C17C18N19118.3°119.3°
C18C17H3117.6°120.0°
C18C28C27117.9°119.8°
C28C18N19122.0°121.4°
C18C28H6121.1°120.1°
C28C27C21118.5°118.3°
C27C28H6121.0°120.1°
C28C27H24120.7°120.9°
C18N19C20121.8°121.3°
C27C21C20120.2°119.2°
C27C21C22120.1°121.2°
C21C27H24120.8°120.8°
N19C20C21119.6°120.0°
N19C20C25120.2°120.9°
C21C20C25120.3°119.1°
C20C21C22119.7°119.6°
C20C25C24119.9°119.8°
C20C25H23120.1°120.1°
C21C22C23120.1°119.7°
C21C22H5120.0°120.1°
C25C24C23120.0°121.0°
C25C24CL26119.9°119.5°
C24C25H23120.0°120.1°
C22C23C24120.0°120.9°
C23C22H5119.9°120.2°
C22C23H22120.0°119.6°
C23C24CL26120.1°119.5°
C24C23H22120.0°119.5°
H7C01H9109.5°109.5°
H7C01H8109.4°109.5°
H9C01H8109.4°109.5°
H12C03H10109.5°109.5°
H12C03H11109.5°109.4°
H10C03H11109.5°109.5°
H13C06H14109.5°109.4°
H15C07H16109.5°109.5°
H25C30H26109.5°109.5°
H28C31H27109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
O33C32O34C31179.7°180.0°
O33C32C31C3098.4°0.0°
O33C32C31H2821.8°119.9°
O33C32C31H27141.3°120.1°
O33C32O34H40.0°0.1°
O34C32C31C3081.3°180.0°
O34C32C31H28158.5°60.0°
O34C32C31H2739.0°60.0°
C32C31C30H28120.2°120.0°
C32C31C30H27120.2°120.1°
C32C31C30S29163.7°180.0°
C32C31C30H2543.8°60.0°
C32C31C30H2676.5°59.9°
C32C31H28H27119.2°120.0°
C31C32O34H4179.7°180.0°
C31C30S29H25119.9°120.0°
C31C30S29H26119.9°120.0°
C31C30S29C09170.4°175.0°
C31C30H25H26120.3°119.9°
C30C31H28H27119.3°120.0°
C30S29C09S082.3°65.7°
C30S29C09C10122.9°174.3°
C30S29C09H17116.0°54.2°
S29C30H25H26120.2°120.1°
S29C30C31H2876.1°60.0°
S29C30C31H2743.4°59.9°
C11C12C13H19180.0°180.0°
C12C11C10H18180.0°179.9°
C11C12C13C140.5°0.3°
C12C11C10C09179.6°180.0°
C12C11C10C150.7°0.3°
C11C12C13H1179.5°180.0°
C13C12C11C100.5°0.0°
C12C13C14H1180.0°179.8°
C12C13C14C150.7°0.2°
C12C13C14C16179.6°180.0°
C13C12C11H18179.5°179.9°
C11C10C09S0835.9°60.2°
C11C10C09S2983.5°59.7°
C11C10C09C15178.9°179.8°
C11C10C15C141.0°0.3°
C11C10C15H2179.1°179.7°
C11C10C09H17157.6°179.7°
C10C11C12H19179.5°180.0°
O05C04N02C010.2°0.0°
O05C04N02C06179.7°180.0°
O05C04N02C03179.0°180.0°
O05C04C06C0733.3°0.0°
O05C04C06H13154.1°120.0°
O05C04C06H1487.4°120.0°
S08C09S29C10120.6°120.0°
S08C09S29H17118.3°120.0°
C09S08C07C06144.4°175.0°
S08C09C10H17121.7°120.0°
S08C09C10C15145.2°120.0°
C09S08C07H1524.8°55.0°
C09S08C07H1696.0°65.0°
S08C07C06C04127.6°180.0°
C07S08C09S2999.7°164.2°
S08C07C06H15119.6°120.0°
S08C07C06H16119.6°120.0°
C07S08C09C10142.2°75.8°
S08C07C06H13111.6°60.0°
S08C07C06H146.9°60.0°
S08C07H15H16121.1°120.0°
C07S08C09H1718.6°44.2°
C01N02C04C03178.8°180.0°
C01N02C04C06179.4°180.0°
N02C01H7H9120.0°120.0°
N02C01H7H8120.0°120.0°
N02C01H9H8120.0°120.0°
C01N02C03H12180.0°90.0°
C01N02C03H1060.0°150.0°
C01N02C03H1160.0°30.0°
N02C04C06C07147.0°180.0°
C04N02C01H7180.0°90.0°
C04N02C01H960.0°30.0°
C04N02C01H860.0°150.0°
C04N02C03H121.2°90.0°
C04N02C03H10121.2°30.0°
C04N02C03H11118.8°150.0°
N02C04C06H1326.2°60.0°
N02C04C06H1492.2°60.0°
C06C04N02C030.7°0.0°
C04C06C07H13120.8°120.0°
C04C06C07H14120.7°120.0°
C04C06H13H14117.6°120.0°
C04C06C07H15112.7°60.0°
C04C06C07H168.0°60.0°
C13C14C15C101.0°0.0°
C13C14C15C16178.9°179.8°
C13C14C16C1797.5°0.0°
C13C14C15H2179.1°180.0°
C14C13C12H19179.5°179.8°
C13C14C16H2082.5°180.0°
S29C09C10H17118.9°120.0°
S29C09C10C1595.4°120.0°
C09S29C30H2550.4°65.1°
C09S29C30H2669.7°55.0°
C03N02C01H71.1°90.0°
C03N02C01H9121.2°150.0°
C03N02C01H8118.9°30.0°
N02C03H12H10120.0°120.0°
N02C03H12H11120.0°120.0°
N02C03H10H11120.0°120.0°
C07C06H13H14117.7°120.0°
C06C07H15H16121.2°120.0°
C09C10C15C14179.9°180.0°
C09C10C15H20.2°0.0°
C09C10C11H180.4°0.0°
C10C15C14H2180.0°180.0°
C10C15C14C16179.9°179.7°
C15C10C09H1723.5°0.0°
C15C10C11H18179.3°179.8°
C15C14C16C1781.4°179.8°
C15C14C13H1179.3°180.0°
C15C14C16H2098.6°0.3°
C14C16C17H20180.0°179.9°
C14C16C17C18178.7°180.0°
C16C14C13H10.4°0.2°
C16C14C15H20.2°0.3°
C14C16C17H31.3°0.0°
C16C17C18H3180.0°180.0°
C16C17C18C2867.1°180.0°
C16C17C18N19112.4°0.8°
C17C18C28N19179.5°179.3°
C17C18C28C27179.8°180.0°
C17C18N19C20179.6°179.8°
C17C18C28H60.3°0.7°
C18C17C16H201.3°0.0°
C18C28C27H6180.0°179.2°
C18C28C27C210.3°0.5°
C28C18N19C200.1°0.5°
C28C18C17H3112.9°0.1°
C18C28C27H24179.7°179.9°
C27C28C18N190.3°0.8°
C28C27C21H24180.0°179.4°
C28C27C21C200.1°0.1°
C28C27C21C22179.9°180.0°
C18N19C20C210.1°0.0°
C18N19C20C25180.0°179.8°
N19C18C17H367.6°179.2°
N19C18C28H6179.7°180.0°
C27C21C20N190.1°0.2°
C27C21C20C22180.0°179.9°
C27C21C20C25180.0°180.0°
C27C21C22C23180.0°180.0°
C27C21C22H50.0°0.1°
C21C27C28H6179.7°179.8°
N19C20C21C25179.9°179.8°
N19C20C21C22179.9°179.7°
N19C20C25C24179.8°179.7°
N19C20C25H230.1°0.2°
C21C20C25C240.1°0.1°
C20C21C22C230.0°0.0°
C20C21C22H5180.0°180.0°
C21C20C25H23179.9°180.0°
C20C21C27H24179.9°179.5°
C25C20C21C220.0°0.1°
C20C25C24H23180.0°179.9°
C20C25C24C230.1°0.1°
C20C25C24CL26179.9°180.0°
C21C22C23H5180.0°180.0°
C21C22C23C240.1°0.1°
C21C22C23H22179.9°180.0°
C22C21C27H240.1°0.6°
C25C24C23C220.1°0.1°
C25C24C23CL26179.9°179.9°
C25C24C23H22179.9°180.0°
C22C23C24H22180.0°179.9°
C22C23C24CL26179.9°180.0°
C24C23C22H5179.9°180.0°
C23C24C25H23179.9°180.0°
CL26C24C23H220.1°0.1°
CL26C24C25H230.0°0.1°
H1C13C12H190.5°0.0°
H3C17C16H20178.7°179.9°
H5C22C23H220.1°0.0°
H6C28C27H240.3°0.8°
H7C01H9H8120.0°120.0°
H12C03H10H11120.0°120.0°
H13C06C07H158.0°180.0°
H13C06C07H16128.8°60.1°
H14C06C07H15126.5°60.0°
H14C06C07H16112.7°180.0°
H18C11C12H190.5°0.1°
H25C30C31H28164.0°179.9°
H25C30C31H2776.5°60.1°
H26C30C31H2843.8°60.0°
H26C30C31H27163.3°180.0°

251422

PDB entries from 2026-04-01

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