Iron in PDB 2blh: Ligand Migration and Protein Fluctuations in Myoglobin Mutant L29W

The structure of Ligand Migration and Protein Fluctuations in Myoglobin Mutant L29W, PDB code: 2blh was solved by K.Nienhaus, A.Ostermann, G.U.Nienhaus, F.G.Parak, M.Schmidt, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	50.00 / 1.77
Space group	P 6
Cell size a, b, c (Å), α, β, γ (°)	92.420, 92.420, 46.790, 90.00, 90.00, 120.00
R / Rfree (%)	18.7 / 20.2

The binding sites of Iron atom in the Ligand Migration and Protein Fluctuations in Myoglobin Mutant L29W (pdb code 2blh). This binding sites where shown within 5.0 Angstroms radius around Iron atom.
In total only one binding site of Iron was determined in the Ligand Migration and Protein Fluctuations in Myoglobin Mutant L29W, PDB code: 2blh:

Iron binding site 1 out of 1 in the Ligand Migration and Protein Fluctuations in Myoglobin Mutant L29W


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 1 of Ligand Migration and Protein Fluctuations in Myoglobin Mutant L29W within 5.0Å range: probe atom residue distance (Å) B Occ A:Fe1154 b:15.1 occ:1.00 FE A:HEM1154 0.0 15.1 1.0 NA A:HEM1154 2.0 13.4 1.0 NB A:HEM1154 2.0 14.2 1.0 NC A:HEM1154 2.0 13.6 1.0 ND A:HEM1154 2.0 12.6 1.0 NE2 A:HIS93 2.2 15.0 1.0 O A:HOH2061 2.3 15.4 1.0 C4A A:HEM1154 3.0 12.7 1.0 C1A A:HEM1154 3.0 13.2 1.0 C4B A:HEM1154 3.0 13.1 1.0 C1B A:HEM1154 3.1 13.7 1.0 C1C A:HEM1154 3.1 14.5 1.0 CE1 A:HIS93 3.1 17.5 1.0 C4C A:HEM1154 3.1 14.1 1.0 C4D A:HEM1154 3.1 14.7 1.0 C1D A:HEM1154 3.1 13.0 1.0 CD2 A:HIS93 3.2 15.8 1.0 CHB A:HEM1154 3.4 13.2 1.0 CHC A:HEM1154 3.4 13.9 1.0 CHA A:HEM1154 3.5 14.4 1.0 CHD A:HEM1154 3.5 13.6 1.0 ND1 A:HIS93 4.2 14.3 1.0 C3A A:HEM1154 4.3 13.4 1.0 C2A A:HEM1154 4.3 13.3 1.0 C3B A:HEM1154 4.3 14.7 1.0 C2B A:HEM1154 4.3 13.6 1.0 C2C A:HEM1154 4.3 15.2 1.0 CG A:HIS93 4.3 14.5 1.0 C3C A:HEM1154 4.3 16.0 1.0 C2D A:HEM1154 4.4 15.8 1.0 C3D A:HEM1154 4.4 16.2 1.0 NE2 A:HIS64 4.6 19.3 1.0 CG2 A:VAL68 4.9 16.0 1.0

K.Nienhaus, A.Ostermann, G.U.Nienhaus, F.G.Parak, M.Schmidt. Ligand Migration and Protein Fluctuations in Myoglobin Mutant L29W Biochemistry V. 44 5095 2005.
ISSN: ISSN 0006-2960
PubMed: 15794647
DOI: 10.1021/BI047513T