Molybdenum in PDB 4uhw: Human Aldehyde Oxidase

All present enzymatic activity of Human Aldehyde Oxidase:
1.2.3.1;

The structure of Human Aldehyde Oxidase, PDB code: 4uhw was solved by C.Coelho, M.J.Romao, T.Santos-Silva, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	105.31 / 2.60
Space group	P 42 21 2
Cell size a, b, c (Å), α, β, γ (°)	148.930, 148.930, 133.250, 90.00, 90.00, 90.00
R / Rfree (%)	18.875 / 23.3

The structure of Human Aldehyde Oxidase also contains other interesting chemical elements:

Iron

(Fe)

4 atoms

The binding sites of Molybdenum atom in the Human Aldehyde Oxidase (pdb code 4uhw). This binding sites where shown within 5.0 Angstroms radius around Molybdenum atom.
In total only one binding site of Molybdenum was determined in the Human Aldehyde Oxidase, PDB code: 4uhw:

Molybdenum binding site 1 out of 1 in the Human Aldehyde Oxidase


Mono view


Stereo pair view

A full contact list of Molybdenum with other atoms in the Mo binding site number 1 of Human Aldehyde Oxidase within 5.0Å range: probe atom residue distance (Å) B Occ A:Mo3004 b:1.0 occ:1.00 MO A:MOS3004 0.0 1.0 1.0 O2 A:MOS3004 1.7 0.5 1.0 O1 A:MOS3004 2.2 0.8 1.0 S A:MOS3004 2.3 0.5 0.6 S1' A:MTE3003 2.4 80.7 1.0 S2' A:MTE3003 2.5 83.4 1.0 C1' A:MTE3003 3.4 81.3 1.0 C2' A:MTE3003 3.4 84.3 1.0 OE2 A:GLU1270 3.8 79.8 1.0 CA A:GLY1087 4.1 70.7 1.0 N A:GLY1088 4.2 77.8 1.0 N A:GLY808 4.3 54.7 1.0 CD A:GLU1270 4.3 80.1 1.0 CA A:GLY808 4.5 55.1 1.0 NE2 A:GLN776 4.5 56.7 1.0 N A:ARG921 4.6 70.2 1.0 C A:GLY1087 4.7 74.9 1.0 C A:PHE807 4.7 55.4 1.0 CA A:ARG921 4.7 71.4 1.0 CG A:GLU1270 4.7 79.1 1.0 C6 A:MTE3003 4.8 80.7 1.0 C3' A:MTE3003 4.9 83.8 1.0 C A:PHE920 4.9 69.3 1.0 O A:PHE920 4.9 72.9 1.0

C.Coelho, A.Foti, T.Hartmann, T.Santos-Silva, S.Leimkuhler, M.J.Romao. Structural Insights Into Xenobiotic and Inhibitor Binding to Human Aldehyde Oxidase Nat.Chem.Biol. V. 11 779 2015.
ISSN: ISSN 1552-4450
PubMed: 26322824
DOI: 10.1038/NCHEMBIO.1895