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A1J30

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
N1C2sing1.47Å1.48Å
C2C10sing1.54Å1.56Å
C2C4sing1.52Å1.52Å
C4N8sing1.35Å1.35ÅAromatic
C4C5doub1.35Å1.35ÅAromatic
C5C6sing1.40Å1.40ÅAromatic
C6N7doub1.31Å1.30ÅAromatic
N7N8sing1.41Å1.40ÅAromatic
N8C9sing1.47Å1.47Å
C9C10sing1.54Å1.55Å
C10C34sing1.52Å1.54Å
C10C11sing1.52Å1.53Å
C11C12sing1.53Å1.53Å
C12N13sing1.47Å1.47Å
N13C14sing1.39Å1.41Å
N13C33sing1.47Å1.48Å
C14N32doub1.33Å1.34ÅAromatic
C14C15sing1.39Å1.42ÅAromatic
C15N16doub1.32Å1.32ÅAromatic
N16C17sing1.33Å1.33ÅAromatic
C17S18sing1.76Å1.76Å
C17C31doub1.39Å1.40ÅAromatic
S18C19sing1.76Å1.78Å
C19C29doub1.39Å1.41ÅAromatic
C19C20sing1.40Å1.40ÅAromatic
C20C21doub1.38Å1.38ÅAromatic
C21N22sing1.32Å1.33ÅAromatic
N22C23doub1.32Å1.32ÅAromatic
C23N24sing1.40Å1.40Å
C23C29sing1.39Å1.39ÅAromatic
N24N28sing1.40Å1.40ÅAromatic
N24C25sing1.36Å1.36ÅAromatic
C25C26doub1.35Å1.35ÅAromatic
C26C27sing1.40Å1.40ÅAromatic
C27N28doub1.31Å1.32ÅAromatic
C29CL30sing1.74Å1.73Å
C31N32sing1.32Å1.33ÅAromatic
C33C34sing1.53Å1.53Å
C2H1sing1.09Å1.10Å
C5H4sing1.08Å1.08Å
C6H5sing1.08Å1.08Å
C11H8sing1.09Å1.10Å
C11H9sing1.09Å1.10Å
C12H10sing1.09Å1.10Å
C12H11sing1.09Å1.10Å
C15H12sing1.08Å1.08Å
C21H14sing1.08Å1.08Å
C27H17sing1.08Å1.08Å
C31H18sing1.08Å1.08Å
C33H19sing1.09Å1.10Å
C33H20sing1.09Å1.10Å
C34H21sing1.09Å1.10Å
C34H22sing1.09Å1.10Å
N1H2sing1.01Å1.00Å
N1H3sing1.01Å1.00Å
C9H6sing1.09Å1.10Å
C9H7sing1.09Å1.10Å
C20H13sing1.08Å1.08Å
C25H15sing1.08Å1.08Å
C26H16sing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
N1C2C10116.2°110.5°
N1C2C4110.2°110.5°
N1C2H1109.0°110.6°
C2N1H2109.5°111.0°
C2N1H3109.5°111.0°
C10C2C4104.7°104.1°
C2C10C9103.5°102.5°
C2C10C34108.6°110.7°
C2C10C11114.0°110.6°
C10C2H1108.0°110.5°
C2C4N8111.3°110.1°
C2C4C5141.3°142.0°
C4C2H1108.5°110.5°
N8C4C5107.4°107.9°
C4N8N7108.6°107.7°
C4N8C9111.6°111.0°
C4C5C6107.7°107.9°
C4C5H4126.2°126.0°
C5C6N7108.9°108.2°
C6C5H4126.2°126.0°
C5C6H5125.5°126.0°
C6N7N8107.5°108.3°
N7C6H5125.6°125.8°
N7N8C9139.9°141.3°
N8C9C10107.2°105.4°
N8C9H6110.1°110.2°
N8C9H7110.0°110.3°
C9C10C34112.0°110.8°
C9C10C11109.7°110.7°
C10C9H6110.0°110.3°
C10C9H7110.0°110.2°
C34C10C11109.0°111.1°
C10C34C33113.7°109.4°
C10C34H21108.4°109.5°
C10C34H22108.4°109.5°
C10C11C12110.5°109.4°
C10C11H8109.2°109.5°
C10C11H9109.2°109.5°
C11C12N13112.2°109.4°
C12C11H8109.2°109.5°
C12C11H9109.2°109.5°
C11C12H10108.8°109.5°
C11C12H11108.8°109.5°
C12N13C14118.9°111.0°
C12N13C33109.9°111.3°
N13C12H10108.8°109.4°
N13C12H11108.8°109.5°
C14N13C33118.4°111.0°
N13C14N32120.3°120.0°
N13C14C15121.3°120.0°
N13C33C34111.1°109.4°
N13C33H19109.1°109.4°
N13C33H20109.1°109.5°
N32C14C15118.4°120.0°
C14N32C31119.7°120.0°
C14C15N16121.4°120.0°
C14C15H12119.3°120.0°
C15N16C17119.4°120.0°
N16C15H12119.3°120.0°
N16C17S18120.3°120.0°
N16C17C31120.1°120.0°
S18C17C31119.6°120.0°
C17S18C19107.1°103.0°
C17C31N32121.0°120.0°
C17C31H18119.5°120.0°
S18C19C29120.9°120.9°
S18C19C20122.0°120.9°
C29C19C20117.1°118.3°
C19C29C23120.3°119.0°
C19C29CL30119.2°120.5°
C19C20C21119.3°119.2°
C19C20H13120.3°120.4°
C20C21N22121.1°121.0°
C20C21H14119.5°119.5°
C21C20H13120.3°120.4°
C21N22C23122.6°121.8°
N22C21H14119.5°119.5°
N22C23N24117.3°119.6°
N22C23C29119.7°120.7°
N24C23C29123.0°119.7°
C23N24N28126.8°126.1°
C23N24C25126.7°126.1°
C23C29CL30120.5°120.5°
N28N24C25106.4°107.8°
N24N28C27108.7°108.3°
N24C25C26109.2°107.6°
N24C25H15125.4°126.1°
C25C26C27107.2°108.0°
C26C25H15125.4°126.2°
C25C26H16126.4°125.9°
C26C27N28108.4°108.4°
C26C27H17125.8°125.8°
C27C26H16126.4°126.1°
N28C27H17125.8°125.8°
N32C31H18119.5°120.0°
C34C33H19109.1°109.5°
C34C33H20109.1°109.5°
C33C34H21108.4°109.5°
C33C34H22108.4°109.5°
H8C11H9109.5°109.5°
H10C12H11109.5°109.5°
H19C33H20109.5°109.5°
H21C34H22109.5°109.5°
H2N1H3109.5°111.0°
H6C9H7109.4°110.3°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
N1C2C10C4121.8°118.6°
N1C2C10H1122.8°122.7°
N1C2C4H1119.3°122.7°
N1C2C4N8117.0°102.9°
N1C2C4C562.7°77.2°
N1C2C10C9109.2°94.3°
N1C2C10C34131.6°147.4°
N1C2C10C119.8°23.8°
C2N1H2H3120.0°124.0°
C10C2C4H1115.1°118.7°
C10C2C4N88.6°15.8°
C10C2C4C5171.7°164.2°
C2C10C9N812.6°24.9°
C2C10C9C34116.8°118.2°
C2C10C9C11122.1°118.1°
C2C10C34C11124.8°123.4°
C2C10C11C12173.8°67.8°
C2C10C34C33175.6°67.8°
C2C10C11H853.7°172.2°
C2C10C11H966.0°52.2°
C2C10C34H2163.8°52.1°
C2C10C34H2255.0°172.2°
C10C2N1H2180.0°180.0°
C10C2N1H360.0°56.0°
C2C10C9H6107.1°94.1°
C2C10C9H7132.3°143.9°
C2C4N8C5179.8°180.0°
C2C4C5C6179.8°179.8°
C2C4N8N7179.8°179.7°
C2C4N8C90.5°0.4°
C4C2C10C912.5°24.3°
C4C2C10C34106.7°94.0°
C4C2C10C11131.6°142.4°
C2C4C5H40.2°0.3°
C4C2N1H261.2°65.3°
C4C2N1H358.8°58.7°
N8C4C5C60.1°0.2°
C4N8N7C60.0°0.3°
C4N8N7C9179.5°179.9°
C4N8C9C108.0°16.5°
N8C4C2H1123.8°134.5°
N8C4C5H4179.9°179.8°
C4N8C9H6111.6°102.5°
C4N8C9H7127.7°135.5°
C4C5C6H4180.0°180.0°
C4C5C6N70.1°0.0°
C5C4N8N70.0°0.3°
C5C4N8C9179.7°179.6°
C5C4C2H156.6°45.5°
C4C5C6H5179.9°180.0°
C5C6N7H5180.0°180.0°
C5C6N7N80.1°0.2°
C6N7N8C9179.5°179.6°
N7C6C5H4179.9°179.9°
N7N8C9C10171.5°163.6°
N8N7C6H5179.9°179.8°
N7N8C9H668.9°77.4°
N7N8C9H751.8°44.6°
N8C9C10H6119.7°119.0°
N8C9C10H7119.7°119.0°
N8C9C10C34104.2°93.3°
N8C9C10C11134.6°143.0°
N8C9H6H7121.1°122.0°
C9C10C34C11121.5°123.6°
C9C10C11C1270.6°179.2°
C9C10C34C3370.7°179.1°
C9C10C2H1128.0°142.9°
C9C10C11H8169.2°59.2°
C9C10C11H949.5°60.8°
C9C10C34H2149.9°60.9°
C9C10C34H22168.7°59.2°
C10C9H6H7121.0°122.0°
C34C10C11C1252.3°55.6°
C10C34C33N1353.7°57.8°
C10C34C33H21120.6°120.0°
C10C34C33H22120.6°119.9°
C34C10C2H18.8°24.7°
C34C10C11H867.8°64.4°
C34C10C11H9172.5°175.6°
C10C34C33H19174.0°62.2°
C10C34C33H2066.5°177.8°
C10C34H21H22118.1°120.0°
C34C10C9H6136.1°147.7°
C34C10C9H715.4°25.7°
C10C11C12H8120.2°120.0°
C10C11C12H9120.2°120.0°
C10C11C12N1359.5°57.9°
C11C10C34C3350.9°55.5°
C11C10C2H1112.9°98.9°
C10C11H8H9119.6°120.0°
C10C11C12H10179.9°62.1°
C10C11C12H1160.9°177.9°
C11C10C34H21171.5°175.5°
C11C10C34H2269.8°64.4°
C11C10C9H615.0°24.0°
C11C10C9H7105.7°98.0°
C11C12N13H10120.4°120.0°
C11C12N13H11120.4°120.0°
C11C12N13C1480.0°173.4°
C11C12N13C3361.1°62.4°
C12C11H8H9119.5°120.1°
C11C12H10H11118.8°120.1°
C12N13C14C33137.8°124.4°
C12N13C14N32138.0°0.0°
C12N13C14C1544.0°180.0°
C12N13C33C3457.0°62.4°
N13C12C11H860.7°62.1°
N13C12C11H9179.7°177.8°
N13C12H10H11118.7°120.0°
C12N13C33H19177.2°57.6°
C12N13C33H2063.3°177.6°
N13C14N32C15178.0°180.0°
N13C14C15N16178.7°180.0°
N13C14N32C31178.8°180.0°
C14N13C33C3484.3°173.5°
C14N13C12H1040.4°66.6°
C14N13C12H11159.6°53.4°
N13C14C15H121.4°0.3°
C14N13C33H1936.0°66.5°
C14N13C33H20155.5°53.5°
C33N13C14N320.2°124.3°
C33N13C14C15178.2°55.6°
N13C33C34H19120.3°120.0°
N13C33C34H20120.2°120.0°
C33N13C12H10178.5°57.6°
C33N13C12H1159.3°177.6°
N13C33H19H20119.3°120.0°
N13C33C34H21174.3°177.8°
N13C33C34H2266.9°62.2°
N32C14C15N160.6°0.0°
C14N32C31C170.3°0.2°
N32C14C15H12179.4°179.7°
C14N32C31H18179.7°179.8°
C14C15N16H12180.0°179.7°
C14C15N16C170.1°0.2°
C15C14N32C310.8°0.0°
C15N16C17S18178.8°180.0°
C15N16C17C310.7°0.4°
N16C17S18C31179.5°179.6°
N16C17S18C1947.1°5.8°
N16C17C31N320.5°0.4°
C17N16C15H12179.9°179.9°
N16C17C31H18179.5°179.6°
C17S18C19C29151.1°76.2°
C17S18C19C2029.6°104.0°
S18C17C31N32179.0°180.0°
S18C17C31H181.0°0.0°
C31C17S18C19133.4°173.7°
C17C31N32H18180.0°180.0°
S18C19C29C20179.3°179.8°
S18C19C20C21179.8°179.8°
S18C19C29C23180.0°179.8°
S18C19C29CL300.2°0.2°
S18C19C20H130.2°0.2°
C29C19C20C210.9°0.1°
C19C29C23N220.1°0.0°
C19C29C23N24178.2°180.0°
C19C29C23CL30179.9°180.0°
C29C19C20H13179.1°179.9°
C19C20C21H13180.0°180.0°
C19C20C21N220.5°0.0°
C20C19C29C230.7°0.1°
C20C19C29CL30179.1°180.0°
C19C20C21H14179.4°179.9°
C20C21N22H14180.0°179.9°
C20C21N22C230.1°0.0°
C21N22C23N24178.8°180.0°
C21N22C23C290.4°0.0°
N22C21C20H13179.5°180.0°
N22C23N24C29178.3°180.0°
N22C23N24N28145.6°155.0°
N22C23N24C2530.9°25.5°
N22C23C29CL30179.8°180.0°
C23N22C21H14179.9°179.9°
C23N24N28C25177.0°179.6°
C23N24C25C26178.2°180.0°
C23N24N28C27178.3°180.0°
N24C23C29CL301.9°0.0°
C23N24C25H151.8°0.1°
C29C23N24N2832.8°25.0°
C29C23N24C25150.8°154.5°
N28N24C25C261.2°0.4°
N24N28C27C260.8°0.3°
N24N28C27H17179.2°179.9°
N28N24C25H15178.8°179.5°
N24C25C26H15180.0°179.9°
N24C25C26C270.7°0.2°
C25N24N28C271.3°0.5°
N24C25C26H16179.3°179.7°
C25C26C27H16180.0°180.0°
C25C26C27N280.1°0.1°
C25C26C27H17179.9°179.7°
C26C27N28H17180.0°179.6°
C27C26C25H15179.3°179.7°
N28C27C26H16179.9°180.0°
C34C33H19H20119.3°120.1°
C33C34H21H22118.1°120.0°
H1C2N1H257.8°57.3°
H1C2N1H3177.8°178.7°
H4C5C6H50.1°0.1°
H8C11C12H1059.7°178.0°
H8C11C12H11178.9°57.9°
H9C11C12H1059.9°57.9°
H9C11C12H1159.3°62.2°
H14C21C20H130.5°0.1°
H17C27C26H160.1°0.3°
H19C33C34H2165.4°57.9°
H19C33C34H2253.3°177.9°
H20C33C34H2154.1°62.2°
H20C33C34H22172.9°57.8°
H15C25C26H160.7°0.4°

258009

PDB entries from 2026-08-12

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