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SummaryGeometryRelated PDB entries

ITF

Bonds
First atomSecond atomBond order typeDistance
(experimental model)		Distance
(ideal model)		Properties
C04N03sing1.35Å1.38ÅAromatic
C04N05doub1.30Å1.36ÅAromatic
N03C02sing1.37Å1.38ÅAromatic
N10C09doub1.31Å1.28Å
N05C01sing1.34Å1.39ÅAromatic
C02C06sing1.51Å1.48Å
C02C01doub1.35Å1.39ÅAromatic
C06C07sing1.53Å1.53Å
C09N11sing1.38Å1.38Å
C09S08sing1.76Å1.83Å
C07S08sing1.81Å1.86Å
C01H1sing1.08Å1.08Å
C04H2sing1.08Å1.08Å
C06H3sing1.09Å1.10Å
C06H4sing1.09Å1.10Å
C07H5sing1.09Å1.10Å
C07H6sing1.09Å1.10Å
N03H7sing0.97Å1.00Å
N10H9sing0.97Å1.00Å
N11H10sing0.97Å1.00Å
N11H11sing0.97Å1.00Å
Angles
First atomSecond atomThird atomAngle
(experimental model)		Angle
(ideal model)
N03C04N05108.8°108.7°
C04N03C02110.5°107.2°
N03C04H2125.6°125.6°
C04N03H7124.7°126.4°
C04N05C01105.5°109.3°
N05C04H2125.6°125.6°
N03C02C06125.2°126.6°
N03C02C01103.6°106.8°
C02N03H7124.7°126.4°
N10C09N11126.1°120.0°
N10C09S08116.8°120.0°
C09N10H9112.0°120.0°
N05C01C02111.5°108.0°
N05C01H1124.2°126.0°
C06C02C01131.2°126.6°
C02C06C07114.0°109.5°
C02C06H3108.3°109.5°
C02C06H4108.3°109.5°
C02C01H1124.2°126.0°
C06C07S08111.6°109.5°
C07C06H3108.3°109.5°
C07C06H4108.3°109.4°
C06C07H5108.9°109.5°
C06C07H6108.9°109.4°
N11C09S08117.1°120.0°
C09N11H10120.0°119.9°
C09N11H11120.0°120.0°
C09S08C07111.4°100.0°
S08C07H5109.0°109.5°
S08C07H6108.9°109.5°
H3C06H4109.5°109.5°
H5C07H6109.4°109.5°
H10N11H11120.0°120.0°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)		Torsion
(ideal model)
N03C04N05H2180.0°179.8°
C04N03C02H7180.0°179.6°
N03C04N05C010.2°0.5°
C04N03C02C06179.9°180.0°
C04N03C02C010.2°0.0°
N05C04N03C020.2°0.3°
C04N05C01C020.1°0.5°
C04N05C01H1179.9°179.8°
N05C04N03H7179.8°179.9°
N03C02C01N050.1°0.3°
N03C02C06C01179.8°180.0°
N03C02C06C0790.7°95.1°
N03C02C01H1179.9°180.0°
C02N03C04H2179.8°180.0°
N03C02C06H3148.6°25.0°
N03C02C06H429.9°145.0°
N10C09N11S08179.8°179.9°
N10C09S08C0753.4°0.0°
N10C09N11H10179.8°180.0°
N10C09N11H110.2°0.1°
N05C01C02C06179.9°179.7°
N05C01C02H1180.0°179.7°
C01N05C04H2179.8°179.8°
C02C06C07H3120.6°120.1°
C02C06C07H4120.7°120.0°
C02C06C07S08157.1°180.0°
C06C02C01H10.1°0.0°
C02C06H3H4117.9°120.0°
C02C06C07H582.5°59.9°
C02C06C07H636.8°60.0°
C06C02N03H70.1°0.3°
C01C02C06C0789.1°85.0°
C01C02C06H331.6°155.0°
C01C02C06H4150.2°35.0°
C01C02N03H7179.8°179.6°
C06C07S08C0929.0°179.9°
C06C07S08H5120.3°120.0°
C06C07S08H6120.3°120.0°
C07C06H3H4117.9°120.0°
C06C07H5H6119.0°120.0°
N11C09S08C07126.4°180.0°
N11C09N10H9179.8°180.0°
C09N11H10H11180.0°179.9°
C09S08C07H591.4°60.0°
C09S08C07H6149.3°60.0°
S08C09N10H90.0°0.1°
S08C09N11H100.0°0.1°
S08C09N11H11180.0°180.0°
S08C07C06H336.5°60.0°
S08C07C06H482.2°60.0°
S08C07H5H6119.0°120.0°
H2C04N03H70.2°0.3°
H3C06C07H5156.8°180.0°
H3C06C07H683.8°60.0°
H4C06C07H538.1°60.0°
H4C06C07H6157.5°180.0°

226262

PDB entries from 2024-10-16

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