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IO5

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C24C23doub1.38Å1.40ÅAromatic
C24C25sing1.38Å1.41ÅAromatic
C23C22sing1.38Å1.40ÅAromatic
C25C26doub1.38Å1.40ÅAromatic
O17C16sing1.43Å1.43Å
C22C21sing1.51Å1.57Å
C22C27doub1.38Å1.41ÅAromatic
C26C27sing1.38Å1.40ÅAromatic
C16C15sing1.53Å1.55Å
C21C28sing1.51Å1.54Å
C21S20sing1.81Å1.86Å
N29C28sing1.35Å1.45Å
C15N12sing1.47Å1.31Å
C28O30doub1.21Å1.18Å
S20C19sing1.76Å1.85Å
N33C32trip1.14Å1.12Å
C13N12sing1.44Å1.37Å
C13C14sing1.55Å1.54Å
N12C11sing1.48Å1.36Å
C32C31sing1.43Å1.51Å
C19C31doub1.41Å1.40ÅAromatic
C19N18sing1.32Å1.32ÅAromatic
C31C03sing1.40Å1.38ÅAromatic
C11C10sing1.46Å1.53Å
N18C07doub1.32Å1.33ÅAromatic
C14N08sing1.48Å1.46Å
C03C02sing1.51Å1.57Å
C03C04doub1.40Å1.39ÅAromatic
C07N08sing1.38Å1.53Å
C07C04sing1.41Å1.42ÅAromatic
C02C01sing1.53Å1.54Å
N08C09sing1.44Å1.47Å
C04C05sing1.43Å1.51Å
C10C09sing1.54Å1.54Å
C05N06trip1.14Å1.12Å
C01H1sing1.09Å1.10Å
C01H2sing1.09Å1.10Å
C01H3sing1.09Å1.10Å
C02H4sing1.09Å1.10Å
C02H5sing1.09Å1.10Å
C09H6sing1.09Å1.10Å
C09H7sing1.09Å1.10Å
C10H8sing1.09Å1.10Å
C10H9sing1.09Å1.10Å
C11H10sing1.09Å1.10Å
C11H11sing1.09Å1.10Å
C13H12sing1.09Å1.10Å
C13H13sing1.09Å1.10Å
C14H14sing1.09Å1.10Å
C14H15sing1.09Å1.10Å
C15H16sing1.09Å1.10Å
C15H17sing1.09Å1.10Å
C16H18sing1.09Å1.10Å
C16H19sing1.09Å1.10Å
C21H20sing1.09Å1.10Å
C23H21sing1.08Å1.08Å
C24H22sing1.08Å1.08Å
C25H23sing1.08Å1.08Å
C26H24sing1.08Å1.08Å
C27H25sing1.08Å1.08Å
N29H27sing0.97Å1.00Å
N29H28sing0.97Å1.00Å
O17H29sing0.97Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C23C24C25119.6°120.0°
C24C23C22120.0°120.0°
C24C23H21120.0°120.0°
C23C24H22120.2°120.0°
C24C25C26120.3°120.0°
C25C24H22120.2°120.0°
C24C25H23119.8°120.0°
C23C22C21120.6°120.0°
C23C22C27120.4°120.0°
C22C23H21120.0°120.0°
C25C26C27119.9°120.0°
C26C25H23119.8°120.0°
C25C26H24120.0°120.0°
O17C16C15107.7°109.5°
O17C16H18109.9°109.5°
O17C16H19109.9°109.5°
C16O17H29109.5°114.0°
C21C22C27119.0°120.0°
C22C21C28107.3°109.5°
C22C21S20109.7°109.5°
C22C21H20109.3°109.5°
C22C27C26119.7°120.0°
C22C27H25120.2°120.0°
C27C26H24120.1°120.0°
C26C27H25120.2°120.1°
C16C15N12112.0°109.5°
C16C15H16108.8°109.4°
C16C15H17108.8°109.5°
C15C16H18109.9°109.5°
C15C16H19109.9°109.5°
C28C21S20114.5°109.5°
C21C28N29119.5°120.0°
C21C28O30120.7°120.0°
C28C21H20109.7°109.5°
C21S20C19113.9°100.0°
S20C21H20106.2°109.5°
N29C28O30119.7°120.1°
C28N29H27120.0°120.0°
C28N29H28120.0°119.9°
C15N12C13108.9°111.0°
C15N12C11107.4°111.0°
N12C15H16108.8°109.5°
N12C15H17108.8°109.5°
S20C19C31119.1°119.6°
S20C19N18120.6°119.6°
N33C32C31179.3°180.0°
N12C13C14116.3°112.7°
C13N12C11113.7°110.0°
N12C13H12107.7°108.8°
N12C13H13107.7°108.9°
C13C14N08112.1°112.6°
C14C13H12107.7°108.8°
C14C13H13107.8°108.8°
C13C14H14108.8°108.8°
C13C14H15108.8°108.9°
N12C11C10113.9°112.2°
N12C11H10108.3°108.9°
N12C11H11108.3°108.9°
C32C31C19121.6°120.4°
C32C31C03120.2°120.5°
C31C19N18120.3°120.8°
C19C31C03118.2°119.1°
C19N18C07123.7°121.8°
C31C03C02120.1°120.8°
C31C03C04120.6°118.3°
C11C10C09113.1°111.9°
C11C10H8108.6°109.0°
C11C10H9108.6°108.9°
C10C11H10108.3°108.9°
C10C11H11108.3°108.9°
N18C07N08114.8°119.6°
N18C07C04118.6°120.8°
C14N08C07112.1°111.0°
C14N08C09120.9°114.3°
N08C14H14108.8°108.8°
N08C14H15108.8°109.0°
C02C03C04119.3°120.9°
C03C02C01114.0°109.5°
C03C02H4108.3°109.4°
C03C02H5108.4°109.5°
C03C04C07118.5°119.2°
C03C04C05114.8°120.4°
N08C07C04126.6°119.6°
C07N08C09119.3°111.0°
C07C04C05126.6°120.5°
C02C01H1109.5°109.4°
C02C01H2109.5°109.5°
C02C01H3109.5°109.5°
C01C02H4108.3°109.5°
C01C02H5108.3°109.5°
N08C09C10112.5°108.8°
N08C09H6108.7°109.7°
N08C09H7108.7°109.6°
C04C05N06179.0°179.9°
C10C09H6108.7°109.6°
C10C09H7108.7°109.6°
C09C10H8108.6°109.0°
C09C10H9108.6°109.0°
H1C01H2109.5°109.5°
H1C01H3109.5°109.5°
H2C01H3109.4°109.5°
H4C02H5109.5°109.5°
H6C09H7109.5°109.6°
H8C10H9109.4°109.0°
H10C11H11109.5°108.9°
H12C13H13109.5°108.8°
H14C14H15109.4°108.7°
H16C15H17109.5°109.5°
H18C16H19109.5°109.5°
H27N29H28120.0°120.1°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C23C24C25H22180.0°180.0°
C24C23C22H21180.0°180.0°
C23C24C25C260.1°0.0°
C24C23C22C21179.5°180.0°
C24C23C22C270.8°0.3°
C23C24C25H23179.9°180.0°
C25C24C23C220.4°0.0°
C24C25C26H23180.0°180.0°
C24C25C26C270.0°0.2°
C25C24C23H21179.5°180.0°
C24C25C26H24180.0°179.9°
C23C22C21C27178.7°179.7°
C23C22C27C260.8°0.5°
C23C22C21C28132.3°57.2°
C23C22C21S20102.8°62.9°
C23C22C21H2013.4°177.1°
C22C23C24H22179.5°180.0°
C23C22C27H25179.2°179.7°
C25C26C27C220.4°0.5°
C25C26C27H24180.0°179.9°
C26C25C24H22179.9°180.0°
C25C26C27H25179.6°179.8°
O17C16C15H18119.7°120.0°
O17C16C15H19119.7°120.0°
O17C16C15N12135.6°65.0°
O17C16C15H1615.2°175.0°
O17C16C15H17104.0°55.0°
O17C16H18H19120.8°120.0°
C21C22C27C26179.5°179.8°
C22C21C28S20122.0°120.0°
C22C21C28H20118.7°120.0°
C22C21S20H20118.1°120.0°
C22C21C28N2983.7°89.2°
C22C21C28O3094.4°90.9°
C22C21S20C19163.2°170.1°
C21C22C23H210.4°0.0°
C21C22C27H250.5°0.0°
C22C27C26H25180.0°179.7°
C27C22C21C2846.4°122.5°
C27C22C21S2078.5°117.5°
C27C22C21H20165.4°2.6°
C27C22C23H21179.2°179.7°
C22C27C26H24179.6°179.6°
C27C26C25H23180.0°179.8°
C16C15N12H16120.4°120.0°
C16C15N12H17120.4°120.0°
C16C15N12C1359.9°66.1°
C16C15N12C11176.6°171.3°
C16C15H16H17118.8°120.0°
C15C16H18H19120.8°120.0°
C15C16O17H29180.0°180.0°
C28C21S20H20121.2°120.0°
C21C28N29O30178.1°179.9°
C28C21S20C1942.5°69.9°
C21C28N29H27178.1°5.1°
C21C28N29H281.9°174.8°
S20C21C28N29154.3°30.8°
S20C21C28O3027.6°149.1°
C21S20C19C31156.5°175.4°
C21S20C19N1824.1°4.6°
N29C28C21H2035.0°150.8°
C28N29H27H28180.0°180.0°
C15N12C13C11119.6°123.2°
C15N12C13C14174.9°142.9°
C15N12C11C10169.5°156.4°
C15N12C11H1069.8°35.8°
C15N12C11H1148.9°82.9°
C15N12C13H1253.9°96.3°
C15N12C13H1364.1°22.1°
N12C15H16H17118.8°120.0°
N12C15C16H18104.7°175.0°
N12C15C16H1915.9°55.0°
O30C28C21H20146.9°29.1°
O30C28N29H270.0°174.8°
O30C28N29H28180.0°5.3°
S20C19C31C320.5°0.0°
S20C19C31N18179.4°180.0°
S20C19C31C03179.5°180.0°
S20C19N18C07179.7°179.7°
C19S20C21H2078.8°50.1°
N33C32C31C19170.5°150.7°
N33C32C31C039.5°29.3°
N12C13C14H12121.0°120.8°
N12C13C14H13121.0°120.8°
C13N12C11C1070.0°80.3°
N12C13C14N0882.1°41.5°
C13N12C11H1050.7°159.0°
C13N12C11H11169.4°40.3°
N12C13H12H13116.9°118.5°
N12C13C14H1438.4°79.2°
N12C13C14H15157.5°162.4°
C13N12C15H1660.5°53.9°
C13N12C15H17179.7°174.0°
C14C13N12C1165.5°93.9°
C13C14N08H14120.4°120.7°
C13C14N08H15120.4°120.9°
C13C14N08C0779.7°168.3°
C13C14N08C0969.3°42.0°
C14C13H12H13116.9°118.4°
C13C14H14H15118.8°118.4°
N12C11C10H10120.7°120.7°
N12C11C10H11120.6°120.6°
N12C11C10C0990.3°60.9°
N12C11C10H8149.1°59.7°
N12C11C10H930.2°178.5°
N12C11H10H11118.0°118.7°
C11N12C13H12173.5°26.9°
C11N12C13H1355.5°145.3°
C11N12C15H1663.1°68.7°
C11N12C15H1756.2°51.3°
C32C31C19C03180.0°180.0°
C32C31C19N18179.9°180.0°
C32C31C03C020.3°0.0°
C32C31C03C04179.9°179.7°
C31C19N18C070.3°0.3°
C19C31C03C02179.7°180.0°
C19C31C03C040.1°0.2°
N18C19C31C030.1°0.0°
C19N18C07N08179.6°179.8°
C19N18C07C040.4°0.3°
C31C03C02C04179.6°179.8°
C31C03C04C070.0°0.2°
C31C03C02C0186.0°90.3°
C31C03C04C05180.0°179.8°
C31C03C02H434.7°149.7°
C31C03C02H5153.3°29.7°
C11C10C09N0861.9°78.7°
C11C10C09H8120.6°120.6°
C11C10C09H9120.6°120.5°
C11C10C09H6177.6°41.2°
C11C10C09H758.5°161.5°
C11C10H8H9118.4°118.8°
C10C11H10H11118.0°118.7°
N18C07N08C1410.0°56.3°
N18C07C04C030.2°0.0°
N18C07N08C04180.0°180.0°
N18C07N08C09159.5°71.9°
N18C07C04C05179.7°180.0°
C14N08C07C09149.6°128.2°
C14N08C07C04170.0°123.6°
C14N08C09C107.7°93.5°
C14N08C09H6112.8°26.3°
C14N08C09H7128.1°146.7°
N08C14C13H12157.0°79.3°
N08C14C13H1338.9°162.3°
N08C14H14H15118.8°118.6°
C02C03C04C07179.6°180.0°
C03C02C01H4120.7°120.0°
C03C02C01H5120.7°120.0°
C02C03C04C050.4°0.0°
C03C02C01H1180.0°60.0°
C03C02C01H260.0°60.0°
C03C02C01H360.0°180.0°
C03C02H4H5118.0°120.0°
C03C04C07N08179.8°180.0°
C03C04C07C05179.9°180.0°
C04C03C02C0194.4°90.0°
C03C04C05N061.0°142.4°
C04C03C02H4145.0°30.0°
C04C03C02H526.3°150.0°
N08C07C04C050.3°0.0°
C07N08C09C10139.1°140.1°
C07N08C09H6100.4°100.1°
C07N08C09H718.7°20.3°
C07N08C14H14159.9°71.0°
C07N08C14H1540.7°47.5°
C04C07N08C0920.4°108.2°
C07C04C05N06178.9°37.6°
C02C01H1H2120.0°120.0°
C02C01H1H3120.0°120.0°
C02C01H2H3120.0°120.0°
C01C02H4H5117.9°120.0°
N08C09C10H6120.4°119.9°
N08C09C10H7120.4°119.8°
N08C09H6H7118.6°120.4°
N08C09C10H8177.5°41.9°
N08C09C10H958.6°160.8°
C09N08C14H1451.1°162.6°
C09N08C14H15170.3°78.9°
C10C09H6H7118.6°120.3°
C09C10H8H9118.3°118.9°
C09C10C11H1030.3°178.5°
C09C10C11H11149.0°59.8°
H1C01H2H3120.0°120.1°
H1C01C02H459.3°60.0°
H1C01C02H559.3°180.0°
H2C01C02H4179.3°180.0°
H2C01C02H560.7°60.0°
H3C01C02H460.7°60.0°
H3C01C02H5179.4°60.0°
H6C09C10H857.1°161.8°
H6C09C10H961.8°79.3°
H7C09C10H862.0°77.9°
H7C09C10H9179.1°40.9°
H8C10C11H1090.2°60.9°
H8C10C11H1128.5°179.6°
H9C10C11H10150.9°57.9°
H9C10C11H1190.4°60.8°
H12C13C14H1482.6°160.0°
H12C13C14H1536.5°41.6°
H13C13C14H14159.4°41.6°
H13C13C14H1581.5°76.7°
H16C15C16H18134.9°55.0°
H16C15C16H19104.5°65.0°
H17C15C16H1815.7°65.0°
H17C15C16H19136.3°175.0°
H18C16O17H2960.3°60.0°
H19C16O17H2960.3°60.0°
H21C23C24H220.5°0.0°
H22C24C25H230.1°0.1°
H23C25C26H240.0°0.1°
H24C26C27H250.4°0.1°

223532

PDB entries from 2024-08-07

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