Iron in PDB 7vuc: Myoglobin Mutant L29I/H64G/V68A

The structure of Myoglobin Mutant L29I/H64G/V68A, PDB code: 7vuc was solved by K.Takahashi, I.V.Korendovych, J.R.H.Tame, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	22.68 / 1.40
Space group	P 6
Cell size a, b, c (Å), α, β, γ (°)	90.019, 90.019, 45.368, 90, 90, 120
R / Rfree (%)	17.6 / 19.5

The binding sites of Iron atom in the Myoglobin Mutant L29I/H64G/V68A (pdb code 7vuc). 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 Myoglobin Mutant L29I/H64G/V68A, PDB code: 7vuc:

Iron binding site 1 out of 1 in the Myoglobin Mutant L29I/H64G/V68A


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 1 of Myoglobin Mutant L29I/H64G/V68A within 5.0Å range: probe atom residue distance (Å) B Occ A:Fe201 b:8.0 occ:1.00 FE A:HEM201 0.0 8.0 1.0 NB A:HEM201 2.0 6.0 1.0 NA A:HEM201 2.0 8.2 1.0 NE2 A:HIS93 2.0 6.2 1.0 NC A:HEM201 2.0 6.9 1.0 ND A:HEM201 2.0 7.2 1.0 N1 A:IMD202 2.2 10.0 1.0 CE1 A:HIS93 2.9 7.5 1.0 C1B A:HEM201 3.0 4.9 1.0 C4B A:HEM201 3.0 5.8 1.0 C4A A:HEM201 3.0 5.5 1.0 C1A A:HEM201 3.0 7.1 1.0 C4C A:HEM201 3.1 6.4 1.0 C1C A:HEM201 3.1 6.2 1.0 CD2 A:HIS93 3.1 6.7 1.0 C4D A:HEM201 3.1 6.6 1.0 C1D A:HEM201 3.1 6.5 1.0 C5 A:IMD202 3.1 11.7 1.0 C2 A:IMD202 3.2 15.6 1.0 H5 A:IMD202 3.2 14.1 1.0 CHB A:HEM201 3.4 6.6 1.0 CHC A:HEM201 3.4 6.0 1.0 H2 A:IMD202 3.4 18.8 1.0 CHD A:HEM201 3.4 6.5 1.0 CHA A:HEM201 3.4 7.2 1.0 ND1 A:HIS93 4.1 7.8 1.0 CG A:HIS93 4.2 7.4 1.0 C2B A:HEM201 4.2 5.5 1.0 C3A A:HEM201 4.2 5.6 1.0 C3B A:HEM201 4.2 6.7 1.0 C2A A:HEM201 4.2 6.2 1.0 C3C A:HEM201 4.3 6.3 1.0 C4 A:IMD202 4.3 14.7 1.0 C2C A:HEM201 4.3 6.9 1.0 C2D A:HEM201 4.3 8.1 1.0 C3D A:HEM201 4.3 7.2 1.0 N3 A:IMD202 4.3 13.6 1.0 CB A:ALA68 5.0 7.9 1.0

S.Bhattacharya, E.G.Margheritis, K.Takahashi, A.Kulesha, A.D'souza, I.Kim, J.H.Yoon, J.R.H.Tame, A.N.Volkov, O.V.Makhlynets, I.V.Korendovych. uc(Nmr)-Guided Directed Evolution. Nature V. 610 389 2022.
ISSN: ESSN 1476-4687
PubMed: 36198791
DOI: 10.1038/S41586-022-05278-9