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A1IDP

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C15C14doub1.38Å1.38ÅAromatic
C15C5sing1.39Å1.40ÅAromatic
C14C8sing1.39Å1.38ÅAromatic
CC1sing1.53Å1.53Å
C3C2sing1.51Å1.51Å
C3C4sing1.53Å1.49Å
C2Nsing1.35Å1.37Å
C2Odoub1.21Å1.22Å
O1C8sing1.36Å1.38Å
O1C9sing1.43Å1.45Å
NC5sing1.40Å1.44Å
NC1sing1.47Å1.50Å
C5C6doub1.39Å1.39ÅAromatic
C8C7doub1.39Å1.39ÅAromatic
C11C12sing1.54Å1.53Å
C11C10sing1.55Å1.53Å
C1C16sing1.51Å1.52Å
C12C13sing1.54Å1.54Å
C12N1sing1.47Å1.47Å
C13C9sing1.54Å1.53Å
C9C10sing1.55Å1.52Å
C6C7sing1.38Å1.38ÅAromatic
C16C21doub1.38Å1.39ÅAromatic
C16C17sing1.38Å1.39ÅAromatic
C21C20sing1.40Å1.39ÅAromatic
C17C18doub1.38Å1.38ÅAromatic
C20C22sing1.43Å1.44Å
C20C19doub1.40Å1.40ÅAromatic
C22N2trip1.14Å1.14Å
C18C19sing1.38Å1.39ÅAromatic
C19C23sing1.51Å1.51Å
C23F2sing1.40Å1.33Å
C23F1sing1.40Å1.31Å
C23Fsing1.40Å1.32Å
C1H1sing1.09Å1.10Å
C3H2sing1.09Å1.10Å
C3H3sing1.09Å1.10Å
C7H4sing1.08Å1.08Å
C9H5sing1.09Å1.10Å
C10H6sing1.09Å1.10Å
C10H7sing1.09Å1.10Å
C11H8sing1.09Å1.10Å
C11H9sing1.09Å1.10Å
C12H10sing1.09Å1.10Å
C13H11sing1.09Å1.10Å
C13H12sing1.09Å1.10Å
C14H13sing1.08Å1.08Å
C15H14sing1.08Å1.08Å
C21H15sing1.08Å1.08Å
C18H16sing1.08Å1.08Å
C17H17sing1.08Å1.08Å
CH18sing1.09Å1.10Å
CH19sing1.09Å1.10Å
CH20sing1.09Å1.10Å
C4H21sing1.09Å1.10Å
C4H22sing1.09Å1.10Å
C4H23sing1.09Å1.10Å
C6H24sing1.08Å1.08Å
N1H25sing1.01Å1.00Å
N1H26sing1.01Å1.00Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C14C15C5120.5°120.0°
C15C14C8119.8°120.0°
C15C14H13120.1°120.0°
C14C15H14119.8°120.0°
C15C5N120.5°120.0°
C15C5C6119.3°120.0°
C5C15H14119.7°120.0°
C14C8O1113.7°119.9°
C14C8C7120.2°120.0°
C8C14H13120.1°120.0°
CC1N111.8°109.5°
CC1C16114.5°109.4°
CC1H1105.8°109.5°
C1CH18109.5°109.5°
C1CH19109.5°109.5°
C1CH20109.5°109.5°
C2C3C4111.4°109.5°
C3C2N118.2°120.0°
C3C2O120.2°120.0°
C2C3H2109.0°109.5°
C2C3H3109.0°109.5°
C4C3H2109.0°109.4°
C4C3H3109.0°109.5°
C3C4H21109.5°109.4°
C3C4H22109.5°109.4°
C3C4H23109.4°109.4°
NC2O121.6°120.0°
C2NC5122.0°120.0°
C2NC1117.7°120.0°
C8O1C9119.1°117.0°
O1C8C7126.1°120.0°
O1C9C13104.4°110.6°
O1C9C10107.1°110.5°
O1C9H5113.9°110.4°
C5NC1120.3°120.0°
NC5C6120.2°120.0°
NC1C16111.9°109.5°
NC1H1106.2°109.5°
C5C6C7120.4°119.9°
C5C6H24119.8°120.0°
C8C7C6120.0°120.0°
C8C7H4120.0°120.0°
C12C11C10103.3°104.2°
C11C12C13104.4°106.6°
C11C12N1114.1°110.0°
C12C11H8111.0°110.5°
C12C11H9111.0°110.5°
C11C12H10109.3°110.0°
C11C10C9102.0°102.7°
C11C10H6111.3°110.8°
C11C10H7111.3°110.9°
C10C11H8111.0°110.5°
C10C11H9111.0°110.5°
C1C16C21120.8°119.9°
C1C16C17120.8°119.9°
C16C1H1105.9°109.5°
C13C12N1109.5°110.0°
C12C13C9106.7°106.6°
C13C12H10109.2°110.0°
C12C13H11110.2°110.0°
C12C13H12110.2°110.1°
N1C12H10110.1°110.1°
C12N1H25109.5°111.0°
C12N1H26109.4°111.1°
C13C9C10105.2°104.2°
C13C9H5112.8°110.5°
C9C13H11110.1°110.0°
C9C13H12110.2°110.0°
C10C9H5112.8°110.6°
C9C10H6111.3°110.8°
C9C10H7111.3°110.8°
C6C7H4120.0°119.9°
C7C6H24119.8°120.0°
C21C16C17118.3°120.1°
C16C21C20122.3°119.9°
C16C21H15118.9°120.0°
C16C17C18120.9°120.3°
C16C17H17119.5°119.9°
C21C20C22119.5°120.2°
C21C20C19118.1°119.7°
C20C21H15118.9°120.1°
C17C18C19120.4°120.1°
C17C18H16119.8°119.9°
C18C17H17119.6°119.9°
C22C20C19122.4°120.1°
C20C22N2178.0°180.0°
C20C19C18120.0°119.8°
C20C19C23120.3°120.1°
C18C19C23119.7°120.0°
C19C18H16119.8°120.0°
C19C23F2112.4°109.5°
C19C23F1113.1°109.4°
C19C23F113.2°109.4°
F2C23F1105.3°109.5°
F2C23F109.0°109.5°
F1C23F103.0°109.5°
H2C3H3109.5°109.4°
H6C10H7109.5°110.7°
H8C11H9109.5°110.5°
H11C13H12109.5°110.1°
H18CH19109.4°109.5°
H18CH20109.5°109.4°
H19CH20109.5°109.5°
H21C4H22109.5°109.5°
H21C4H23109.5°109.5°
H22C4H23109.5°109.5°
H25N1H26109.4°111.0°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C14C15C5H14180.0°180.0°
C15C14C8H13180.0°179.9°
C15C14C8O1179.6°180.0°
C14C15C5N178.1°179.9°
C14C15C5C60.5°0.2°
C15C14C8C70.0°0.1°
C5C15C14C80.2°0.0°
C15C5NC292.7°69.0°
C15C5NC6178.6°179.7°
C15C5NC189.0°111.0°
C15C5C6C70.7°0.5°
C5C15C14H13179.8°180.0°
C15C5C6H24179.3°180.0°
C14C8O1C7179.5°180.0°
C14C8O1C9179.9°174.9°
C14C8C7C60.1°0.2°
C14C8C7H4179.9°180.0°
C8C14C15H14179.8°180.0°
CC1NC2125.4°124.0°
CC1NC556.2°56.0°
CC1NC16130.0°119.9°
CC1NH1115.0°120.0°
CC1C16H1116.2°120.0°
CC1C16C2118.8°115.1°
CC1C16C17159.4°64.6°
C1CH18H19120.0°120.0°
C1CH18H20120.0°120.0°
C1CH19H20120.0°120.0°
C2C3C4H2120.3°120.0°
C2C3C4H3120.3°120.0°
C3C2NO178.6°180.0°
C3C2NC510.9°174.9°
C3C2NC1170.8°5.1°
C2C3H2H3119.1°120.1°
C2C3C4H21180.0°60.0°
C2C3C4H2260.0°180.0°
C2C3C4H2360.0°60.0°
C4C3C2N107.2°175.0°
C4C3C2O71.5°5.0°
C4C3H2H3119.1°119.9°
C3C4H21H22120.0°119.9°
C3C4H21H23120.0°120.0°
C3C4H22H23120.0°120.0°
C2NC5C1178.3°180.0°
C2NC5C688.7°110.7°
C2NC1C16104.6°116.0°
C2NC1H110.4°4.0°
NC2C3H213.1°55.0°
NC2C3H3132.5°65.0°
OC2NC5167.8°5.1°
OC2NC110.6°174.9°
OC2C3H2168.2°125.0°
OC2C3H348.8°115.0°
C8O1C9C13165.5°159.3°
C8O1C9C1083.3°85.9°
O1C8C7C6179.6°179.8°
O1C8C7H40.4°0.0°
C8O1C9H542.1°36.7°
O1C8C14H130.4°0.0°
C9O1C8C70.4°5.1°
O1C9C10C1174.7°156.8°
O1C9C13C1297.2°142.3°
O1C9C13C10112.5°118.7°
O1C9C13H5124.1°122.5°
O1C9C10H5126.1°122.5°
O1C9C10H6166.5°38.4°
O1C9C10H744.1°84.8°
O1C9C13H1122.3°98.4°
O1C9C13H12143.2°23.0°
C5NC1C1673.7°64.0°
NC5C6C7177.9°179.8°
C5NC1H1171.2°176.0°
NC5C15H141.9°0.1°
NC5C6H242.1°0.3°
C1NC5C689.6°69.3°
NC1C16H1115.2°120.1°
NC1C16C21109.8°124.9°
NC1C16C1772.0°55.3°
NC1CH18180.0°53.4°
NC1CH1960.0°66.6°
NC1CH2060.0°173.4°
C5C6C7C80.5°0.4°
C5C6C7H24180.0°179.6°
C5C6C7H4179.5°179.7°
C6C5C15H14179.5°179.8°
C8C7C6H4180.0°179.8°
C7C8C14H13180.0°180.0°
C8C7C6H24179.5°180.0°
C12C11C10H8119.0°118.7°
C12C11C10H9119.0°118.7°
C11C12C13N1122.6°119.3°
C11C12C13H10116.8°119.3°
C11C12N1H10123.3°121.4°
C11C12C13C911.5°0.0°
C12C11C10C943.2°38.0°
C12C11C10H675.6°80.4°
C12C11C10H7162.0°156.3°
C12C11H8H9122.9°122.6°
C11C12C13H11108.0°119.3°
C11C12C13H12131.1°119.3°
C11C12N1H25180.0°61.5°
C11C12N1H2660.0°62.5°
C10C11C12C1333.8°23.6°
C10C11C12N185.7°142.9°
C11C10C9C1336.0°38.0°
C11C10C9H6118.8°118.3°
C11C10C9H7118.8°118.5°
C11C10C9H5159.2°80.7°
C11C10H6H7123.5°123.4°
C10C11H8H9122.9°122.7°
C10C11C12H10150.5°95.7°
C1C16C21C17178.2°179.8°
C1C16C21C20178.6°180.0°
C1C16C17C18178.3°180.0°
C1C16C21H151.4°0.0°
C1C16C17H171.7°0.1°
C16C1CH1851.4°173.4°
C16C1CH19171.4°53.4°
C16C1CH2068.6°66.6°
C13C12N1H10120.1°121.4°
C12C13C9H11119.6°119.3°
C12C13C9H12119.6°119.3°
C12C13C9C1015.3°23.6°
C12C13C9H5138.6°95.1°
C13C12C11H8152.8°142.3°
C13C12C11H985.2°95.1°
C12C13H11H12121.3°121.5°
C13C12N1H2563.4°178.7°
C13C12N1H26176.6°54.6°
N1C12C13C9111.1°119.2°
N1C12C11H833.3°98.4°
N1C12C11H9155.2°24.2°
N1C12C13H11129.4°0.0°
N1C12C13H128.5°121.5°
C12N1H25H26120.0°124.0°
C13C9C10H5123.3°118.7°
C13C9C10H682.8°80.4°
C13C9C10H7154.7°156.5°
C9C13C12H10128.3°119.3°
C9C13H11H12121.3°121.4°
C9C10H6H7123.5°123.3°
C9C10C11H8162.2°156.6°
C9C10C11H975.8°80.7°
C10C9C13H11134.9°142.9°
C10C9C13H12104.3°95.6°
C16C21C20H15180.0°180.0°
C21C16C17C180.1°0.2°
C16C21C20C22179.6°180.0°
C16C21C20C190.1°0.1°
C21C16C1H1134.9°4.9°
C21C16C17H17179.9°179.7°
C17C16C21C200.3°0.2°
C16C17C18H17180.0°180.0°
C16C17C18C190.3°0.0°
C17C16C1H143.3°175.4°
C17C16C21H15179.7°179.8°
C16C17C18H16179.7°179.7°
C21C20C22C19179.7°179.9°
C21C20C22N27.5°115.8°
C21C20C19C180.3°0.4°
C21C20C19C23179.1°180.0°
C17C18C19C200.5°0.3°
C17C18C19H16180.0°179.7°
C17C18C19C23179.4°180.0°
C22C20C19C18180.0°179.7°
C22C20C19C231.1°0.1°
C22C20C21H150.4°0.0°
C19C20C22N2172.8°64.3°
C20C19C18C23178.9°179.7°
C20C19C23F266.1°180.0°
C20C19C23F153.1°59.9°
C20C19C23F169.8°60.0°
C19C20C21H15179.9°179.9°
C20C19C18H16179.5°180.0°
C18C19C23F2112.8°0.3°
C18C19C23F1128.1°119.7°
C18C19C23F11.3°120.3°
C19C18C17H17179.7°180.0°
C19C23F2F1123.6°120.0°
C19C23F2F126.4°120.0°
C19C23F1F122.6°120.0°
C23C19C18H160.6°0.3°
F2C23F1F114.2°120.0°
H1C1CH1864.8°66.6°
H1C1CH1955.2°173.4°
H1C1CH20175.1°53.3°
H2C3C4H2159.7°60.0°
H2C3C4H22179.7°60.0°
H2C3C4H2360.3°180.0°
H3C3C4H2159.7°179.9°
H3C3C4H2260.3°60.0°
H3C3C4H23179.7°60.1°
H4C7C6H240.5°0.2°
H5C9C10H640.5°160.9°
H5C9C10H782.0°37.7°
H5C9C13H11101.8°24.1°
H5C9C13H1219.0°145.6°
H6C10C11H843.4°38.3°
H6C10C11H9165.4°161.0°
H7C10C11H879.0°85.0°
H7C10C11H942.9°37.7°
H8C11C12H1090.5°23.0°
H9C11C12H1031.5°145.6°
H10C12C13H118.8°121.4°
H10C12C13H12112.1°0.0°
H10C12N1H2556.7°59.9°
H10C12N1H2663.3°176.1°
H13C14C15H140.2°0.0°
H16C18C17H170.3°0.3°
H18CH19H20120.0°120.0°
H21C4H22H23120.0°120.1°

248335

PDB entries from 2026-01-28

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