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V1D

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
OCdoub1.21Å1.23Å
O2C11sing1.43Å1.40Å
C2C1sing1.54Å1.55Å
C2Nsing1.48Å1.57Å
CC1sing1.51Å1.51Å
CN1sing1.35Å1.34Å
O1C11sing1.43Å1.39Å
C1C4sing1.54Å1.55Å
C9C8sing1.53Å1.54Å
C9C10sing1.53Å1.53Å
C7C6sing1.53Å1.53Å
C7C8sing1.53Å1.53Å
C5N1sing1.47Å1.45Å
C5C6sing1.53Å1.53Å
C5C15sing1.51Å1.51Å
C11C10sing1.53Å1.52Å
C11C12sing1.51Å1.56Å
NC4sing1.48Å1.55Å
NC3sing1.47Å1.49Å
N3C15sing1.35Å1.35ÅAromatic
N3C16sing1.37Å1.35ÅAromatic
C15N4doub1.30Å1.33ÅAromatic
N2C12doub1.30Å1.30ÅAromatic
N2O3sing1.21Å1.42ÅAromatic
C12C13sing1.41Å1.44ÅAromatic
C16C17doub1.36Å1.36ÅAromatic
N4C17sing1.35Å1.41ÅAromatic
O3C14sing1.34Å1.34ÅAromatic
C17C18sing1.48Å1.47Å
C13C14doub1.35Å1.34ÅAromatic
FC23sing1.35Å1.35Å
C18C23doub1.40Å1.39ÅAromatic
C18C19sing1.39Å1.39ÅAromatic
C23C22sing1.38Å1.37ÅAromatic
C19C20doub1.38Å1.38ÅAromatic
C22C21doub1.38Å1.38ÅAromatic
C20C21sing1.38Å1.38ÅAromatic
C22H1sing1.08Å1.08Å
C21H2sing1.08Å1.08Å
C20H3sing1.08Å1.08Å
C19H4sing1.08Å1.08Å
C16H5sing1.08Å1.08Å
N3H6sing0.97Å1.00Å
C5H8sing1.09Å1.10Å
N1H9sing0.97Å1.00Å
C1H10sing1.09Å1.10Å
C4H11sing1.09Å1.10Å
C4H12sing1.09Å1.10Å
C3H14sing1.09Å1.10Å
C3H15sing1.09Å1.10Å
C3H16sing1.09Å1.10Å
C2H17sing1.09Å1.10Å
C2H18sing1.09Å1.10Å
C6H19sing1.09Å1.10Å
C6H20sing1.09Å1.10Å
C7H21sing1.09Å1.10Å
C7H22sing1.09Å1.10Å
C8H23sing1.09Å1.10Å
C8H24sing1.09Å1.10Å
C9H25sing1.09Å1.10Å
C9H26sing1.09Å1.10Å
C10H27sing1.09Å1.10Å
C10H28sing1.09Å1.10Å
O1H29sing0.97Å0.95Å
O2H30sing0.97Å0.95Å
C14H31sing1.08Å1.08Å
C13H32sing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
OCC1122.6°120.0°
OCN1124.0°120.0°
O2C11O1111.4°109.5°
O2C11C10114.1°109.4°
O2C11C12110.4°109.5°
C11O2H30109.5°114.0°
C1C2N88.2°86.2°
C2C1C119.9°113.7°
C2C1C489.8°86.4°
C2C1H10110.5°113.8°
C1C2H17114.5°113.8°
C1C2H18114.5°113.7°
C2NC488.8°90.8°
C2NC3116.5°111.0°
NC2H17114.5°113.7°
NC2H18114.5°113.7°
C1CN1113.4°120.0°
CC1C4113.3°113.7°
CC1H10111.0°112.9°
CN1C5124.7°120.0°
CN1H9117.6°120.0°
O1C11C10110.0°109.5°
O1C11C12105.6°109.5°
C11O1H29109.5°114.0°
C1C4N88.8°86.2°
C4C1H10110.5°113.8°
C1C4H11114.3°113.8°
C1C4H12114.3°113.7°
C8C9C10111.2°109.5°
C9C8C7115.7°109.5°
C9C8H23107.9°109.5°
C9C8H24107.9°109.5°
C8C9H25109.0°109.5°
C8C9H26109.0°109.5°
C9C10C11116.5°109.5°
C10C9H25109.0°109.5°
C10C9H26109.0°109.5°
C9C10H27107.7°109.5°
C9C10H28107.7°109.5°
C6C7C8112.7°109.5°
C7C6C5116.0°109.5°
C7C6H19107.8°109.4°
C7C6H20107.8°109.5°
C6C7H21108.7°109.4°
C6C7H22108.7°109.5°
C8C7H21108.6°109.4°
C8C7H22108.6°109.5°
C7C8H23107.9°109.5°
C7C8H24107.9°109.5°
N1C5C6109.6°109.5°
N1C5C15108.3°109.4°
N1C5H8109.9°109.5°
C5N1H9117.7°120.0°
C6C5C15111.0°109.5°
C6C5H8108.8°109.5°
C5C6H19107.8°109.4°
C5C6H20107.8°109.5°
C5C15N3124.8°125.5°
C5C15N4124.4°125.5°
C15C5H8109.2°109.4°
C10C11C12104.8°109.5°
C11C10H27107.7°109.5°
C11C10H28107.7°109.5°
C11C12N2124.7°126.8°
C11C12C13125.5°126.8°
C4NC3113.6°111.0°
NC4H11114.4°113.7°
NC4H12114.3°113.8°
NC3H14109.5°109.5°
NC3H15109.5°109.5°
NC3H16109.5°109.5°
C15N3C16108.9°107.4°
N3C15N4110.8°109.0°
C15N3H6125.5°126.4°
N3C16C17106.3°106.7°
N3C16H5126.9°126.7°
C16N3H6125.6°126.2°
C15N4C17105.0°109.2°
C12N2O3106.6°111.6°
N2C12C13109.9°106.4°
N2O3C14108.4°111.6°
C12C13C14105.3°104.0°
C12C13H32127.3°128.0°
C16C17N4109.0°107.7°
C16C17C18129.6°126.2°
C17C16H5126.9°126.6°
N4C17C18121.4°126.1°
O3C14C13109.8°106.4°
O3C14H31125.1°126.8°
C17C18C23123.1°120.1°
C17C18C19120.0°120.1°
C13C14H31125.1°126.8°
C14C13H32127.3°128.0°
FC23C18118.9°120.1°
FC23C22117.9°120.1°
C23C18C19116.9°119.8°
C18C23C22123.2°119.8°
C18C19C20120.8°119.9°
C18C19H4119.6°120.1°
C23C22C21118.4°120.1°
C23C22H1120.8°119.9°
C19C20C21120.3°120.1°
C19C20H3119.8°119.9°
C20C19H4119.6°120.0°
C22C21C20120.3°120.3°
C21C22H1120.8°120.0°
C22C21H2119.8°119.9°
C20C21H2119.9°119.8°
C21C20H3119.9°119.9°
H11C4H12109.5°113.0°
H14C3H15109.5°109.4°
H14C3H16109.5°109.5°
H15C3H16109.5°109.4°
H17C2H18109.5°113.0°
H19C6H20109.5°109.5°
H21C7H22109.5°109.5°
H23C8H24109.5°109.4°
H25C9H26109.5°109.5°
H27C10H28109.5°109.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
OCC1C21.9°96.8°
OCC1N1178.9°179.9°
OCC1C4102.1°0.1°
OCN1C50.2°0.1°
OCN1H9179.8°180.0°
OCC1H10132.8°131.5°
O2C11O1C10127.5°120.0°
O2C11O1C12119.8°120.0°
O2C11C10C968.7°60.0°
O2C11C10C12120.9°120.0°
O2C11C12N22.1°120.3°
O2C11C12C13177.7°60.1°
O2C11C10H2752.3°60.0°
O2C11C10H28170.3°179.9°
O2C11O1H29180.0°180.0°
C1C2NH17116.2°114.4°
C1C2NH18116.2°114.3°
C2C1CC4104.1°96.7°
C2C1CH10130.9°131.7°
C2C1CN1179.2°83.3°
C2C1C4H10111.9°114.5°
C1C2NC415.6°24.7°
C1C2NC3100.3°137.6°
C2C1C4H11100.5°138.0°
C2C1C4H12132.2°90.7°
C1C2H17H18130.1°131.7°
NC2C1C132.7°90.6°
C2NC4C3118.6°112.9°
NC2C1H1096.2°138.1°
C2NC4H11100.7°139.0°
C2NC4H12132.0°89.7°
C2NC3H14180.0°39.3°
C2NC3H1560.0°80.6°
C2NC3H1660.0°159.4°
NC2H17H18130.1°131.7°
CC1C4H10125.4°131.2°
C1CN1C5179.1°180.0°
CC1C4N138.6°90.6°
C1CN1H90.9°0.0°
CC1C4H1122.3°23.7°
CC1C4H12105.1°155.0°
CC1C2H17111.1°155.0°
CC1C2H1816.5°23.6°
N1CC1C476.8°180.0°
CN1C5H9180.0°180.0°
CN1C5C6136.7°60.0°
CN1C5C15102.0°60.0°
CN1C5H817.2°179.9°
N1CC1H1048.3°48.4°
O1C11C10C957.3°60.0°
O1C11C10C12113.1°120.0°
O1C11C12N2118.4°119.7°
O1C11C12C1361.8°59.9°
O1C11C10H27178.3°180.0°
O1C11C10H2863.7°60.1°
O1C11O2H30180.0°180.0°
C1C4NH11116.3°114.4°
C1C4NH12116.3°114.3°
C1C4NC3102.9°137.6°
C1C4H11H12129.8°131.7°
C4C1C2H17131.9°90.6°
C4C1C2H18100.5°138.0°
C8C9C10H25120.3°120.0°
C8C9C10H26120.3°120.0°
C9C8C7C6175.7°180.0°
C9C8C7H23120.9°120.0°
C9C8C7H24120.9°120.1°
C8C9C10C11163.7°180.0°
C9C8C7H2163.8°60.0°
C9C8C7H2255.2°60.0°
C9C8H23H24117.1°120.0°
C8C9H25H26119.2°120.0°
C8C9C10H2742.7°60.0°
C8C9C10H2875.3°60.0°
C10C9C8C7170.1°180.0°
C9C10C11H27121.0°120.0°
C9C10C11H28121.0°120.1°
C9C10C11C12170.4°180.0°
C10C9C8H2349.2°60.0°
C10C9C8H2469.0°60.0°
C10C9H25H26119.2°120.0°
C9C10H27H28116.8°120.0°
C6C7C8H21120.5°119.9°
C6C7C8H22120.5°120.0°
C7C6C5N1165.1°65.0°
C7C6C5H19120.9°119.9°
C7C6C5H20121.0°120.1°
C7C6C5C1575.2°175.0°
C7C6C5H844.9°55.1°
C7C6H19H20117.0°120.1°
C6C7H21H22118.5°120.0°
C6C7C8H2363.4°60.0°
C6C7C8H2454.8°59.9°
C8C7C6C5177.8°180.0°
C8C7C6H1956.8°60.1°
C8C7C6H2061.3°59.9°
C8C7H21H22118.5°120.0°
C7C8H23H24117.2°120.0°
C7C8C9H2549.9°60.0°
C7C8C9H2669.6°60.0°
N1C5C6C15119.7°120.0°
N1C5C6H8120.2°120.0°
N1C5C15H8119.7°120.0°
N1C5C15N3139.0°5.0°
N1C5C15N442.9°174.8°
N1C5C6H1974.0°55.0°
N1C5C6H2044.1°174.9°
C6C5C15H8119.9°120.0°
C6C5C15N3100.6°125.0°
C6C5C15N477.5°54.7°
C6C5N1H943.3°120.0°
C5C6H19H20117.0°120.0°
C5C6C7H2157.3°60.1°
C5C6C7H2261.8°60.0°
C5C15N3N4178.3°179.8°
C5C15N3C16178.2°180.0°
C5C15N4C17178.1°179.8°
C5C15N3H61.8°0.2°
C15C5N1H978.0°120.0°
C15C5C6H1945.7°65.0°
C15C5C6H20163.8°55.0°
C10C11C12N2125.4°0.3°
C10C11C12C1354.3°180.0°
C11C10C9H2576.1°60.0°
C11C10C9H2643.4°60.0°
C11C10H27H28116.8°120.0°
C10C11O1H2952.5°60.0°
C10C11O2H3054.7°60.0°
C11C12N2C13179.8°179.7°
C11C12N2O3179.6°180.0°
C11C12C13C14179.6°179.9°
C12C11C10H2768.5°60.0°
C12C11C10H2849.4°60.0°
C12C11O1H2960.1°60.0°
C12C11O2H3063.0°60.0°
C11C12C13H320.4°0.0°
NC4C1H1096.0°138.2°
NC4H11H12129.8°131.7°
C4NC3H1478.9°60.1°
C4NC3H1541.1°180.0°
C4NC3H16161.1°60.0°
C4NC2H17131.9°89.7°
C4NC2H18100.5°139.0°
C3NC4H11140.8°108.0°
C3NC4H1213.4°23.3°
NC3H14H15120.0°120.0°
NC3H14H16120.0°120.1°
NC3H15H16120.0°120.1°
C3NC2H1716.0°23.2°
C3NC2H18143.5°108.1°
C15N3C16H6180.0°179.7°
C15N3C16C170.0°0.0°
N3C15N4C170.2°0.4°
C15N3C16H5180.0°179.9°
N3C15C5H819.3°114.9°
C16N3C15N40.2°0.2°
N3C16C17H5180.0°179.9°
N3C16C17N40.1°0.2°
N3C16C17C18179.7°179.9°
C15N4C17C160.2°0.4°
C15N4C17C18179.6°179.9°
N4C15N3H6179.8°180.0°
N4C15C5H8162.5°65.3°
C12N2O3C140.1°0.0°
N2C12C13C140.2°0.4°
N2C12C13H32179.8°179.7°
O3N2C12C130.2°0.3°
N2O3C14C130.1°0.2°
N2O3C14H31179.9°180.0°
C12C13C14O30.2°0.4°
C12C13C14H32180.0°179.9°
C12C13C14H31179.8°179.9°
C16C17N4C18179.8°179.7°
C16C17C18C2315.9°180.0°
C16C17C18C19163.7°0.3°
C17C16N3H6180.0°179.7°
N4C17C18C23164.4°0.4°
N4C17C18C1916.1°180.0°
N4C17C16H5179.9°179.7°
O3C14C13H31180.0°179.7°
O3C14C13H32179.8°179.8°
C17C18C23F1.7°0.1°
C17C18C23C19179.6°179.7°
C17C18C23C22179.9°179.8°
C17C18C19C20179.3°179.8°
C17C18C19H40.7°0.0°
C18C17C16H50.3°0.0°
FC23C18C22178.3°179.7°
FC23C18C19177.8°179.7°
FC23C22C21177.5°180.0°
FC23C22H12.6°0.0°
C23C18C19C200.3°0.5°
C18C23C22C210.9°0.3°
C18C23C22H1179.1°179.7°
C23C18C19H4179.7°179.7°
C19C18C23C220.5°0.5°
C18C19C20H4180.0°179.8°
C18C19C20C210.7°0.3°
C18C19C20H3179.4°179.8°
C23C22C21H1180.0°180.0°
C23C22C21C200.5°0.0°
C23C22C21H2179.5°180.0°
C19C20C21C220.3°0.0°
C19C20C21H3180.0°179.9°
C19C20C21H2179.8°180.0°
C22C21C20H2180.0°180.0°
C22C21C20H3179.8°179.9°
C20C21C22H1179.5°180.0°
C21C20C19H4179.4°179.9°
H1C22C21H20.5°0.0°
H2C21C20H30.2°0.1°
H3C20C19H40.6°0.0°
H5C16N3H60.0°0.3°
H8C5N1H9162.8°0.1°
H8C5C6H19165.8°175.0°
H8C5C6H2076.1°65.0°
H10C1C4H11147.6°107.5°
H10C1C4H1220.3°23.8°
H10C1C2H1720.0°23.8°
H10C1C2H18147.6°107.6°
H14C3H15H16120.0°120.0°
H19C6C7H2163.7°180.0°
H19C6C7H22177.3°60.0°
H20C6C7H21178.2°60.0°
H20C6C7H2259.2°180.0°
H21C7C8H2357.1°180.0°
H21C7C8H24175.3°60.0°
H22C7C8H23176.1°60.0°
H22C7C8H2465.7°179.9°
H23C8C9H2571.0°180.0°
H23C8C9H26169.5°60.0°
H24C8C9H25170.8°60.0°
H24C8C9H2651.3°179.9°
H25C9C10H27162.9°180.0°
H25C9C10H2844.9°60.0°
H26C9C10H2777.6°60.0°
H26C9C10H28164.4°180.0°
H31C14C13H320.2°0.0°

225946

PDB entries from 2024-10-09

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