Iron in PDB 8c9i: Cytochrome P450 CYP141A1 (RV3121) From Mycobacterium Tuberculosis

The structure of Cytochrome P450 CYP141A1 (RV3121) From Mycobacterium Tuberculosis, PDB code: 8c9i was solved by I.R.Selvam, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	82.29 / 2.05
Space group	P 65 2 2
Cell size a, b, c (Å), α, β, γ (°)	95.019, 95.019, 264.785, 90, 90, 120
R / Rfree (%)	20.7 / 23

The binding sites of Iron atom in the Cytochrome P450 CYP141A1 (RV3121) From Mycobacterium Tuberculosis (pdb code 8c9i). 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 Cytochrome P450 CYP141A1 (RV3121) From Mycobacterium Tuberculosis, PDB code: 8c9i:

Iron binding site 1 out of 1 in the Cytochrome P450 CYP141A1 (RV3121) From Mycobacterium Tuberculosis


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 1 of Cytochrome P450 CYP141A1 (RV3121) From Mycobacterium Tuberculosis within 5.0Å range: probe atom residue distance (Å) B Occ A:Fe501 b:38.7 occ:1.00 FE A:HEB501 0.0 38.7 1.0 NC A:HEB501 2.0 38.3 1.0 NB A:HEB501 2.1 41.2 1.0 NA A:HEB501 2.1 37.6 1.0 ND A:HEB501 2.1 43.3 1.0 O A:HOH602 2.1 51.4 0.8 SG A:CYS347 2.3 40.2 1.0 C1C A:HEB501 3.1 45.7 1.0 C4C A:HEB501 3.1 43.4 1.0 C4B A:HEB501 3.1 42.9 1.0 C1B A:HEB501 3.1 43.9 1.0 C4A A:HEB501 3.1 48.2 1.0 C1D A:HEB501 3.1 40.0 1.0 C1A A:HEB501 3.1 44.1 1.0 C4D A:HEB501 3.1 41.4 1.0 HB2 A:CYS347 3.2 50.1 1.0 CB A:CYS347 3.4 41.7 1.0 CHC A:HEB501 3.4 42.4 1.0 CHD A:HEB501 3.4 41.0 1.0 CHB A:HEB501 3.4 41.6 1.0 CHA A:HEB501 3.5 41.1 1.0 HA A:CYS347 3.7 46.0 1.0 HD2 A:PRO348 3.8 48.0 1.0 CA A:CYS347 4.1 38.3 1.0 HB3 A:CYS347 4.1 50.1 1.0 C2C A:HEB501 4.3 42.0 1.0 C3C A:HEB501 4.3 39.5 1.0 C3B A:HEB501 4.3 45.4 1.0 C2B A:HEB501 4.3 41.0 1.0 HB3 A:ALA349 4.3 51.6 1.0 C3A A:HEB501 4.3 43.8 1.0 C2D A:HEB501 4.3 45.9 1.0 C2A A:HEB501 4.3 44.8 1.0 C3D A:HEB501 4.3 43.2 1.0 HHC A:HEB501 4.4 51.0 1.0 HHD A:HEB501 4.4 49.3 1.0 HHB A:HEB501 4.4 50.1 1.0 H A:ALA349 4.4 50.6 1.0 HHA A:HEB501 4.4 49.4 1.0 O A:HOH758 4.5 57.5 1.0 HD1 A:PHE340 4.5 45.9 1.0 HG21 A:THR240 4.5 52.7 1.0 O A:GLY236 4.7 60.4 1.0 CD A:PRO348 4.7 39.9 1.0

I.R.Selvam, I.R.Selvam. N/A N/A.