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Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
O01C02sing1.43Å1.38Å
C02C03sing1.55Å1.51Å
C02C26sing1.55Å1.47Å
C03C04sing1.54Å1.50Å
C04C05sing1.51Å1.58Å
C04N16sing1.47Å1.47Å
C05N06sing1.35Å1.48Å
C05O15doub1.21Å1.23Å
N06C07sing1.47Å1.45Å
C07C08sing1.51Å1.50Å
C08C09sing1.38Å1.43ÅAromatic
C08C14doub1.38Å1.40ÅAromatic
C09C10doub1.38Å1.38ÅAromatic
C10C11sing1.38Å1.41ÅAromatic
C11CL1sing1.74Å1.75Å
C11C13doub1.38Å1.42ÅAromatic
C13C14sing1.38Å1.37ÅAromatic
N16C17sing1.35Å1.51Å
N16C26sing1.47Å1.44Å
C17C18sing1.48Å1.51Å
C17O25doub1.22Å1.24Å
C18C19sing1.40Å1.43ÅAromatic
C18C24doub1.40Å1.38ÅAromatic
C19CL2sing1.74Å1.71Å
C19C21doub1.38Å1.35ÅAromatic
C21C22sing1.38Å1.41ÅAromatic
C22C23doub1.38Å1.39ÅAromatic
C23C24sing1.38Å1.38ÅAromatic
O01H01sing0.97Å0.95Å
C02H02sing1.09Å1.10Å
C03H031sing1.09Å1.10Å
C03H032sing1.09Å1.10Å
C26H261sing1.09Å1.10Å
C26H262sing1.09Å1.10Å
C04H04sing1.09Å1.10Å
N06H06sing0.97Å1.00Å
C07H071sing1.09Å1.10Å
C07H072sing1.09Å1.10Å
C09H09sing1.08Å1.08Å
C14H14sing1.08Å1.08Å
C10H10sing1.08Å1.08Å
C13H13sing1.08Å1.08Å
C24H24sing1.08Å1.08Å
C21H21sing1.08Å1.08Å
C22H22sing1.08Å1.08Å
C23H23sing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
O01C02C03112.8°111.0°
O01C02C26107.3°111.0°
C02O01H01109.5°114.0°
O01C02H02112.1°110.9°
C03C02C26103.5°101.6°
C02C03C04101.8°103.0°
C03C02H02110.1°111.0°
C02C03H031111.3°110.7°
C02C03H032111.4°110.8°
C02C26N16103.8°104.8°
C26C02H02110.7°111.0°
C02C26H261110.8°110.4°
C02C26H262110.9°110.3°
C03C04C05111.4°109.9°
C03C04N16105.6°107.3°
C04C03H031111.4°110.7°
C04C03H032111.3°110.7°
C03C04H04107.2°109.9°
C05C04N16118.3°109.9°
C04C05N06118.4°119.9°
C04C05O15120.9°120.0°
C05C04H04106.3°109.9°
C04N16C17124.6°125.7°
C04N16C26108.8°108.7°
N16C04H04107.6°110.0°
N06C05O15120.7°120.0°
C05N06C07123.7°120.0°
C05N06H06118.2°120.1°
N06C07C08111.2°109.5°
C07N06H06118.1°119.9°
N06C07H071109.0°109.5°
N06C07H072109.0°109.5°
C07C08C09122.1°120.0°
C07C08C14118.2°120.0°
C08C07H071109.0°109.5°
C08C07H072109.0°109.5°
C09C08C14119.8°120.0°
C08C09C10119.7°120.0°
C08C09H09120.1°120.0°
C08C14C13120.6°120.0°
C08C14H14119.7°120.0°
C09C10C11119.8°120.0°
C10C09H09120.2°120.0°
C09C10H10120.1°120.0°
C10C11CL1122.3°120.0°
C10C11C13120.1°120.0°
C11C10H10120.1°120.0°
CL1C11C13117.5°120.0°
C11C13C14119.9°120.0°
C11C13H13120.0°120.0°
C13C14H14119.7°120.0°
C14C13H13120.0°120.0°
C17N16C26126.6°125.6°
N16C17C18120.6°120.0°
N16C17O25120.3°120.0°
N16C26H261110.9°110.4°
N16C26H262110.9°110.4°
C18C17O25119.0°119.9°
C17C18C19118.8°120.1°
C17C18C24120.2°120.1°
C19C18C24120.9°119.7°
C18C19CL2120.5°120.1°
C18C19C21120.3°119.8°
C18C24C23118.4°119.9°
C18C24H24120.8°120.1°
CL2C19C21119.2°120.1°
C19C21C22119.0°120.1°
C19C21H21120.5°120.0°
C21C22C23120.7°120.3°
C22C21H21120.5°119.9°
C21C22H22119.7°119.8°
C22C23C24120.6°120.2°
C23C22H22119.7°119.9°
C22C23H23119.7°119.9°
C23C24H24120.7°120.0°
C24C23H23119.7°119.9°
H031C03H032109.5°110.8°
H261C26H262109.5°110.4°
H071C07H072109.5°109.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
O01C02C03C26115.6°118.1°
O01C02C03H02126.0°123.8°
O01C02C26H02122.5°123.8°
O01C02C03C0476.5°82.5°
O01C02C26N1680.8°81.1°
O01C02C03H03142.2°35.8°
O01C02C03H032164.7°159.1°
O01C02C26H261160.1°160.1°
O01C02C26H26238.3°37.8°
C03C02C26H02118.0°118.1°
C02C03C04H031118.7°118.3°
C02C03C04H032118.8°118.4°
C02C03C04C05154.4°141.6°
C02C03C04N1624.8°22.2°
C03C02C26N1638.7°37.0°
C03C02O01H01180.0°180.0°
C02C03H031H032123.6°123.3°
C03C02C26H26180.4°81.9°
C03C02C26H262157.7°155.8°
C02C03C04H0489.7°97.3°
C26C02C03C0439.1°35.5°
C02C26N16C0423.1°24.2°
C02C26N16C17154.3°155.9°
C02C26N16H261119.1°118.9°
C02C26N16H262119.1°118.8°
C26C02O01H0166.7°67.8°
C26C02C03H031157.8°153.9°
C26C02C03H03279.7°82.8°
C02C26H261H262122.6°122.2°
C03C04C05N16122.6°117.8°
C03C04C05H04116.5°121.0°
C03C04N16H04114.3°119.5°
C03C04C05N0671.3°80.0°
C03C04C05O15109.4°100.0°
C03C04N16C17179.1°179.0°
C03C04N16C261.6°1.1°
C04C03C02H02157.4°153.6°
C04C03H031H032123.6°123.2°
C05C04N16H04120.3°121.1°
C04C05N06O15179.3°180.0°
C04C05N06C07174.8°180.0°
C05C04N16C1755.5°61.6°
C05C04N16C26127.1°118.4°
C05C04C03H03186.8°100.1°
C05C04C03H03235.7°23.2°
C04C05N06H065.2°0.0°
N16C04C05N06166.1°162.2°
N16C04C05O1513.2°17.8°
C04N16C17C26177.0°180.0°
C04N16C17C18179.4°174.7°
C04N16C17O252.9°5.3°
N16C04C03H031143.5°140.5°
N16C04C03H03293.9°96.2°
C04N16C26H26195.9°94.7°
C04N16C26H262142.2°142.9°
C05N06C07H06180.0°180.0°
C05N06C07C08108.0°180.0°
N06C05C04H0445.2°41.0°
C05N06C07H07112.2°60.0°
C05N06C07H072131.7°60.0°
O15C05N06C075.9°0.0°
O15C05C04H04134.1°139.0°
O15C05N06H06174.1°180.0°
N06C07C08H071120.3°120.0°
N06C07C08H072120.3°120.0°
N06C07C08C09169.0°90.0°
N06C07C08C149.0°90.3°
N06C07H071H072119.2°120.0°
C07C08C09C14178.0°179.7°
C07C08C09C10178.1°180.0°
C07C08C14C13176.1°179.8°
C08C07N06H0672.0°0.0°
C08C07H071H072119.2°120.0°
C07C08C09H091.9°0.0°
C07C08C14H143.9°0.0°
C08C09C10H09180.0°180.0°
C08C09C10C110.9°0.0°
C09C08C14C131.9°0.5°
C09C08C07H07148.7°30.0°
C09C08C07H07270.7°150.0°
C09C08C14H14178.1°179.7°
C08C09C10H10179.1°179.9°
C14C08C09C100.1°0.3°
C08C14C13C113.2°0.5°
C08C14C13H14180.0°179.7°
C14C08C07H071129.3°149.7°
C14C08C07H072111.3°29.7°
C14C08C09H09179.9°179.7°
C08C14C13H13176.8°179.7°
C09C10C11H10180.0°179.9°
C09C10C11CL1177.7°180.0°
C09C10C11C130.3°0.1°
C10C11CL1C13177.4°179.9°
C10C11C13C142.4°0.2°
C11C10C09H09179.1°180.0°
C10C11C13H13177.6°180.0°
CL1C11C13C14179.9°179.7°
CL1C11C10H102.3°0.1°
CL1C11C13H130.1°0.1°
C11C13C14H13180.0°179.8°
C11C13C14H14176.8°179.8°
C13C11C10H10179.7°180.0°
N16C17C18O25176.5°179.9°
N16C17C18C1981.3°142.4°
N16C17C18C2497.0°37.8°
C17N16C26H26186.7°85.3°
C17N16C26H26235.2°37.1°
C17N16C04H0464.8°59.5°
C26N16C17C183.6°5.3°
C26N16C17O25180.0°174.8°
N16C26C02H02156.7°155.1°
N16C26H261H262122.6°122.3°
C26N16C04H04112.7°120.5°
C17C18C19C24178.3°179.8°
C17C18C19CL20.9°0.1°
C17C18C19C21178.5°180.0°
C17C18C24C23178.7°179.7°
C17C18C24H241.3°0.1°
O25C17C18C1995.2°37.7°
O25C17C18C2486.5°142.1°
C18C19CL2C21177.6°179.9°
C18C19C21C223.0°0.1°
C19C18C24C230.4°0.6°
C19C18C24H24179.6°179.7°
C18C19C21H21177.0°180.0°
C24C18C19CL2179.2°179.7°
C24C18C19C213.2°0.2°
C18C24C23C222.4°0.6°
C18C24C23H24180.0°179.7°
C18C24C23H23177.6°179.7°
CL2C19C21C22179.4°180.0°
CL2C19C21H210.6°0.1°
C19C21C22H21180.0°179.9°
C19C21C22C230.2°0.1°
C19C21C22H22179.9°179.9°
C21C22C23H22180.0°180.0°
C21C22C23C242.6°0.3°
C21C22C23H23177.4°180.0°
C22C23C24H23180.0°179.7°
C22C23C24H24177.6°179.7°
C23C22C21H21179.8°180.0°
C24C23C22H22177.3°179.7°
H01O01C02H0255.0°56.1°
H02C02C03H03183.8°88.0°
H02C02C03H03238.7°35.3°
H02C02C26H26137.6°36.2°
H02C02C26H26284.3°86.1°
H031C03C04H0429.0°21.0°
H032C03C04H04151.6°144.3°
H06N06C07H071167.8°120.0°
H06N06C07H07248.3°120.0°
H09C09C10H100.9°0.1°
H14C14C13H133.1°0.0°
H24C24C23H232.4°0.0°
H21C21C22H220.1°0.0°
H22C22C23H232.6°0.0°

223532

PDB entries from 2024-08-07

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