Iron in PDB 8j4l: X-Ray Crystal Structure of F46C Myoglobin with A Covalently Linked Triazole Group

The structure of X-Ray Crystal Structure of F46C Myoglobin with A Covalently Linked Triazole Group, PDB code: 8j4l was solved by H.Yuan, Y.W.Lin, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	31.23 / 1.45
Space group	P 21 21 21
Cell size a, b, c (Å), α, β, γ (°)	39.928, 50.13, 76.208, 90, 90, 90
R / Rfree (%)	15.7 / 20.1

The binding sites of Iron atom in the X-Ray Crystal Structure of F46C Myoglobin with A Covalently Linked Triazole Group (pdb code 8j4l). 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 X-Ray Crystal Structure of F46C Myoglobin with A Covalently Linked Triazole Group, PDB code: 8j4l:

Iron binding site 1 out of 1 in the X-Ray Crystal Structure of F46C Myoglobin with A Covalently Linked Triazole Group


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 1 of X-Ray Crystal Structure of F46C Myoglobin with A Covalently Linked Triazole Group within 5.0Å range: probe atom residue distance (Å) B Occ A:Fe201 b:9.5 occ:1.00 FE A:HEM201 0.0 9.5 1.0 NA A:HEM201 1.9 8.7 1.0 NB A:HEM201 2.0 9.2 1.0 ND A:HEM201 2.0 9.8 1.0 NC A:HEM201 2.0 8.8 1.0 O A:HOH306 2.1 18.2 1.0 NE2 A:HIS93 2.2 9.5 1.0 C1D A:HEM201 3.0 11.1 1.0 C1B A:HEM201 3.0 8.7 1.0 C4B A:HEM201 3.0 9.0 1.0 C4C A:HEM201 3.0 10.0 1.0 C4A A:HEM201 3.0 8.1 1.0 C1A A:HEM201 3.0 9.7 1.0 C1C A:HEM201 3.0 8.3 1.0 C4D A:HEM201 3.1 10.1 1.0 CE1 A:HIS93 3.1 11.0 1.0 CD2 A:HIS93 3.2 10.3 1.0 CHC A:HEM201 3.4 9.8 1.0 CHD A:HEM201 3.4 10.3 1.0 CHB A:HEM201 3.4 8.8 1.0 CHA A:HEM201 3.5 9.2 1.0 O A:HOH471 4.2 28.1 1.0 NE2 A:HIS64 4.2 16.7 1.0 ND1 A:HIS93 4.2 10.5 1.0 C2C A:HEM201 4.3 10.6 1.0 C3A A:HEM201 4.3 8.3 1.0 C2B A:HEM201 4.3 9.4 1.0 C2D A:HEM201 4.3 10.6 1.0 C2A A:HEM201 4.3 10.2 1.0 C3C A:HEM201 4.3 10.7 1.0 C3B A:HEM201 4.3 8.3 1.0 CG A:HIS93 4.3 9.0 1.0 C3D A:HEM201 4.4 10.8 1.0 CE1 A:HIS64 4.5 18.1 1.0 CG2 A:VAL68 4.7 10.3 1.0 CD2 A:HIS97 5.0 12.7 1.0

H.Yuan, Y.W.Lin. X-Ray Crystal Structure of F46C Myoglobin with A Covalently Linked Triazole Group To Be Published.