Magnesium in PDB 2lwi: Solution Structure of H-RAST35S Mutant Protein in Complex with KOBE2601

The structure of Solution Structure of H-RAST35S Mutant Protein in Complex with KOBE2601 also contains other interesting chemical elements:

Fluorine

(F)

15 atoms

The binding sites of Magnesium atom in the Solution Structure of H-RAST35S Mutant Protein in Complex with KOBE2601 (pdb code 2lwi). This binding sites where shown within 5.0 Angstroms radius around Magnesium atom.
In total only one binding site of Magnesium was determined in the Solution Structure of H-RAST35S Mutant Protein in Complex with KOBE2601, PDB code: 2lwi:

Magnesium binding site 1 out of 1 in the Solution Structure of H-RAST35S Mutant Protein in Complex with KOBE2601


Mono view


Stereo pair view

A full contact list of Magnesium with other atoms in the Mg binding site number 1 of Solution Structure of H-RAST35S Mutant Protein in Complex with KOBE2601 within 5.0Å range: probe atom residue distance (Å) B Occ A:Mg202 b:54.0 occ:1.00 H2 A:HOH303 2.0 24.0 1.0 H1 A:HOH301 2.1 32.4 1.0 O2G A:GNP201 2.1 63.4 1.0 OG A:SER17 2.2 12.2 1.0 O A:HOH302 2.2 54.2 1.0 O A:HOH303 2.2 24.5 1.0 O2B A:GNP201 2.3 22.3 1.0 O A:HOH301 2.3 12.5 1.0 H1 A:HOH302 2.4 2.3 1.0 HG A:SER17 2.6 5.5 1.0 H1 A:HOH303 2.8 75.4 1.0 HB2 A:SER17 3.0 45.3 1.0 O1G A:GNP201 3.1 73.2 1.0 H2 A:HOH302 3.1 34.3 1.0 CB A:SER17 3.1 15.3 1.0 H2 A:HOH301 3.1 23.4 1.0 PG A:GNP201 3.2 21.4 1.0 PB A:GNP201 3.5 13.4 1.0 HB3 A:SER17 3.6 54.3 1.0 N3B A:GNP201 3.8 24.1 1.0 HNB3 A:GNP201 3.9 65.4 1.0 HG13 A:VAL29 4.0 64.2 1.0 HG22 A:VAL29 4.0 43.4 1.0 O3A A:GNP201 4.1 41.3 1.0 H A:ALA18 4.2 51.4 1.0 CA A:SER17 4.4 24.1 1.0 O3G A:GNP201 4.4 52.1 1.0 N A:ALA18 4.5 44.1 1.0 HB1 A:ALA18 4.6 11.4 1.0 HG12 A:VAL29 4.6 15.1 1.0 H A:SER17 4.6 4.2 1.0 HB A:VAL29 4.6 52.1 1.0 C A:SER17 4.7 74.2 1.0 HO2' A:GNP201 4.7 33.4 1.0 CG1 A:VAL29 4.7 45.4 1.0 O1B A:GNP201 4.8 12.4 1.0 H2' A:GNP201 4.8 21.2 1.0 OH A:TYR32 4.9 31.0 1.0 CG2 A:VAL29 4.9 61.4 1.0 N A:SER17 5.0 32.1 1.0

F.Shima, Y.Yoshikawa, M.Ye, M.Araki, S.Matsumoto, J.Liao, L.Hu, T.Sugimoto, Y.Ijiri, A.Takeda, Y.Nishiyama, C.Sato, S.Muraoka, A.Tamura, T.Osoda, K.I.Tsuda, T.Miyakawa, H.Fukunishi, J.Shimada, T.Kumasaka, M.Yamamoto, T.Kataoka. In Silico Discovery of Small-Molecule Ras Inhibitors That Display Antitumor Activity By Blocking the Ras-Effector Interaction. Proc.Natl.Acad.Sci.Usa 2013.
ISSN: ESSN 1091-6490
PubMed: 23630290
DOI: 10.1073/PNAS.1217730110