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DHA

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
NCAsing1.40Å1.44Å
NHsing0.97Å1.00Å
NH2sing0.97Å1.00Å
CACBdoub1.34Å1.33Å
CACsing1.48Å1.44Å
CBHB1sing1.08Å1.08Å
CBHB2sing1.08Å1.08Å
COdoub1.21Å1.24Å
COXTsing1.35Å1.36Å
OXTHXTsing0.97Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
CANH109.5°120.0°
CANH2109.4°120.0°
NCACB120.4°120.0°
NCAC117.6°120.0°
HNH2109.5°120.0°
CBCAC121.9°119.9°
CACBHB1109.3°120.0°
CACBHB2125.4°120.1°
CACO119.8°120.0°
CACOXT120.3°119.9°
HB1CBHB2125.4°120.0°
OCOXT119.9°120.1°
COXTHXT109.5°116.9°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
CANHH2120.0°179.7°
NCACBC175.6°180.0°
NCACBHB1180.0°0.0°
NCACBHB20.0°180.0°
NCACO152.6°180.0°
NCACOXT27.4°0.0°
HNCACB158.2°0.0°
HNCAC17.5°180.0°
H2NCACB38.2°179.7°
H2NCAC137.5°0.3°
CACBHB1HB2180.0°180.0°
CBCACO31.7°0.0°
CBCACOXT148.3°180.0°
CCACBHB14.4°180.0°
CCACBHB2175.6°0.0°
CACOOXT180.0°180.0°
CACOXTHXT180.0°180.0°
OCOXTHXT0.0°0.0°

226707

PDB entries from 2024-10-30

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