Magnesium in PDB 1saw: X-Ray Structure of Homo Sapiens Protein FLJ36880

The structure of X-Ray Structure of Homo Sapiens Protein FLJ36880, PDB code: 1saw was solved by B.A.Manjasetty, F.H.Niesen, H.Delbrueck, F.Goetz, V.Sievert, K.Buessow, J.Behlke, U.Heinemann, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	19.65 / 2.20
Space group	P 21 21 21
Cell size a, b, c (Å), α, β, γ (°)	50.792, 77.239, 114.195, 90.00, 90.00, 90.00
R / Rfree (%)	20.4 / 23.9

The structure of X-Ray Structure of Homo Sapiens Protein FLJ36880 also contains other interesting chemical elements:

Chlorine

(Cl)

1 atom

The binding sites of Magnesium atom in the X-Ray Structure of Homo Sapiens Protein FLJ36880 (pdb code 1saw). This binding sites where shown within 5.0 Angstroms radius around Magnesium atom.
In total 3 binding sites of Magnesium where determined in the X-Ray Structure of Homo Sapiens Protein FLJ36880, PDB code: 1saw:
Jump to Magnesium binding site number: 1; 2; 3;

Magnesium binding site 1 out of 3 in the X-Ray Structure of Homo Sapiens Protein FLJ36880


Mono view


Stereo pair view

A full contact list of Magnesium with other atoms in the Mg binding site number 1 of X-Ray Structure of Homo Sapiens Protein FLJ36880 within 5.0Å range: probe atom residue distance (Å) B Occ A:Mg225 b:35.0 occ:1.00 OE1 A:GLU71 2.0 17.9 1.0 O A:HOH353 2.1 33.8 1.0 O A:HOH358 2.1 29.8 1.0 OE2 A:GLU73 2.2 16.1 1.0 OD2 A:ASP102 2.2 11.8 1.0 O A:HOH320 2.3 31.7 1.0 CD A:GLU71 3.2 17.1 1.0 CD A:GLU73 3.2 16.5 1.0 CG A:ASP102 3.2 13.8 1.0 OE1 A:GLU73 3.5 18.3 1.0 NZ A:LYS123 3.6 17.4 1.0 CB A:ASP102 3.7 14.2 1.0 OE2 A:GLU71 3.8 17.1 1.0 O A:VAL23 3.9 21.1 1.0 O A:GLY24 4.0 22.6 1.0 CB A:GLU71 4.3 16.6 1.0 CG A:GLU71 4.3 16.8 1.0 OD1 A:ASP102 4.3 13.4 1.0 CG A:GLU73 4.5 15.6 1.0 O A:HOH327 4.5 36.9 1.0 CZ A:PHE45 4.6 14.3 1.0 CA A:GLY191 4.7 11.1 1.0 N A:THR192 4.7 11.3 1.0 CB A:THR192 4.8 11.2 1.0 O A:HOH356 4.8 46.7 1.0 CE2 A:PHE45 4.8 14.4 1.0 CE A:LYS123 4.8 16.2 1.0 CG2 A:THR192 4.8 11.2 1.0 C A:GLY191 5.0 11.3 1.0 C A:GLY24 5.0 21.6 1.0

Magnesium binding site 2 out of 3 in the X-Ray Structure of Homo Sapiens Protein FLJ36880


Mono view


Stereo pair view

A full contact list of Magnesium with other atoms in the Mg binding site number 2 of X-Ray Structure of Homo Sapiens Protein FLJ36880 within 5.0Å range: probe atom residue distance (Å) B Occ A:Mg226 b:28.7 occ:1.00 O A:LYS18 2.3 8.1 1.0 O B:LYS18 2.3 12.2 1.0 O A:HOH312 2.4 28.2 1.0 OD1 A:ASN19 2.4 8.6 1.0 O B:HOH242 2.6 26.7 1.0 OD1 B:ASN19 2.7 14.2 1.0 C A:LYS18 3.1 9.1 1.0 C B:LYS18 3.4 12.1 1.0 CG A:ASN19 3.4 9.9 1.0 CA A:ASN19 3.6 9.5 1.0 CG B:ASN19 3.7 13.1 1.0 N A:ASN19 3.7 9.3 1.0 CA B:ASN19 3.9 13.3 1.0 CB A:ASN19 3.9 9.3 1.0 N B:ASN19 4.0 12.7 1.0 CA A:LYS18 4.2 8.9 1.0 CB B:ASN19 4.3 13.0 1.0 CB A:LYS18 4.3 9.4 1.0 N B:SER49 4.4 13.0 1.0 CA B:LYS18 4.4 11.7 1.0 N A:SER49 4.4 10.5 1.0 ND2 A:ASN19 4.5 8.0 1.0 CB B:LYS18 4.6 11.5 1.0 ND2 B:ASN19 4.7 12.8 1.0 O B:HOH288 4.7 50.0 1.0 CA A:PRO48 4.8 11.7 1.0 CA B:PRO48 4.8 13.7 1.0 O A:LYS47 4.8 12.4 1.0 C A:ASN19 4.8 9.7 1.0 O B:LYS47 4.9 14.8 1.0 CB B:SER49 4.9 12.9 1.0 C A:PRO48 5.0 11.1 1.0

Magnesium binding site 3 out of 3 in the X-Ray Structure of Homo Sapiens Protein FLJ36880


Mono view


Stereo pair view

A full contact list of Magnesium with other atoms in the Mg binding site number 3 of X-Ray Structure of Homo Sapiens Protein FLJ36880 within 5.0Å range: probe atom residue distance (Å) B Occ B:Mg225 b:40.0 occ:1.00 O B:HOH273 2.0 44.3 1.0 OE2 B:GLU73 2.1 17.2 1.0 O B:HOH272 2.2 36.0 1.0 OD2 B:ASP102 2.3 21.7 1.0 OE1 B:GLU71 2.3 21.4 1.0 O B:HOH246 2.4 51.0 1.0 CD B:GLU73 3.1 18.7 1.0 CG B:ASP102 3.2 20.6 1.0 OE1 B:GLU73 3.5 20.8 1.0 CD B:GLU71 3.5 20.7 1.0 CB B:ASP102 3.6 19.9 1.0 O B:VAL23 3.6 25.0 1.0 NZ B:LYS123 3.9 18.4 1.0 OE2 B:GLU71 4.1 21.6 1.0 CZ B:PHE45 4.3 19.9 1.0 O B:GLY24 4.4 27.6 1.0 OD1 B:ASP102 4.4 23.5 1.0 CG B:GLU73 4.4 19.0 1.0 CB B:GLU71 4.5 20.6 1.0 CA B:GLY191 4.6 19.6 1.0 O B:HOH285 4.6 42.0 1.0 CG B:GLU71 4.6 20.5 1.0 CE2 B:PHE45 4.7 20.3 1.0 C B:VAL23 4.7 24.8 1.0 CG2 B:THR192 4.8 20.4 1.0 N B:THR192 4.9 19.9 1.0 CE B:LYS123 4.9 18.9 1.0 CB B:CYS22 4.9 21.7 1.0 CB B:THR192 5.0 20.3 1.0

B.A.Manjasetty, F.H.Niesen, H.Delbruck, F.Gotz, V.Sievert, K.Bussow, J.Behlke, U.Heinemann. X-Ray Structure of Fumarylacetoacetate Hydrolase Family Member Homo Sapiens FLJ36880. Biol.Chem. V. 385 935 2004.
ISSN: ISSN 1431-6730
PubMed: 15551868
DOI: 10.1515/BC.2004.122