Iron in PDB 1gdj: Crystal Structure of Ferric Complexes of the Yellow Lupin Leghemoglobin with Isoquinoline at 1.8 Angstroms Resolution (Russian)

The structure of Crystal Structure of Ferric Complexes of the Yellow Lupin Leghemoglobin with Isoquinoline at 1.8 Angstroms Resolution (Russian), PDB code: 1gdj was solved by E.Harutyunyan, T.Safonova, I.Kuranova, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	8.00 / 1.70
Space group	C 1 2 1
Cell size a, b, c (Å), α, β, γ (°)	93.480, 51.600, 38.330, 90.00, 98.80, 90.00
R / Rfree (%)	n/a / n/a

The binding sites of Iron atom in the Crystal Structure of Ferric Complexes of the Yellow Lupin Leghemoglobin with Isoquinoline at 1.8 Angstroms Resolution (Russian) (pdb code 1gdj). 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 Crystal Structure of Ferric Complexes of the Yellow Lupin Leghemoglobin with Isoquinoline at 1.8 Angstroms Resolution (Russian), PDB code: 1gdj:

Iron binding site 1 out of 1 in the Crystal Structure of Ferric Complexes of the Yellow Lupin Leghemoglobin with Isoquinoline at 1.8 Angstroms Resolution (Russian)


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 1 of Crystal Structure of Ferric Complexes of the Yellow Lupin Leghemoglobin with Isoquinoline at 1.8 Angstroms Resolution (Russian) within 5.0Å range: probe atom residue distance (Å) B Occ A:Fe154 b:10.8 occ:1.00 FE A:HEM154 0.0 10.8 1.0 NA A:HEM154 1.8 2.7 1.0 ND A:HEM154 2.1 10.4 1.0 NC A:HEM154 2.1 11.1 1.0 NB A:HEM154 2.1 7.2 1.0 NE2 A:HIS97 2.1 6.9 0.4 NE2 A:HIS97 2.2 2.1 0.6 CE1 A:HIS97 2.6 5.7 0.4 C4A A:HEM154 2.9 11.2 1.0 C1A A:HEM154 2.9 7.0 1.0 C1B A:HEM154 3.0 2.9 1.0 CE1 A:HIS97 3.1 1.4 0.6 C4C A:HEM154 3.1 12.5 1.0 C4D A:HEM154 3.1 9.6 1.0 C1D A:HEM154 3.1 8.7 1.0 C1C A:HEM154 3.2 7.2 1.0 C4B A:HEM154 3.2 1.4 1.0 CD2 A:HIS97 3.3 1.4 0.6 CHB A:HEM154 3.4 6.1 1.0 CHA A:HEM154 3.4 7.2 1.0 CD2 A:HIS97 3.4 5.9 0.4 CHD A:HEM154 3.4 12.7 1.0 CHC A:HEM154 3.6 4.7 1.0 ND1 A:HIS97 3.9 6.0 0.4 O A:HOH371 4.1 25.6 1.0 C2A A:HEM154 4.1 9.4 1.0 CE1 A:HIS63 4.1 7.6 1.0 C3A A:HEM154 4.1 6.0 1.0 ND1 A:HIS97 4.2 1.4 0.6 CG A:HIS97 4.3 6.8 0.4 C2B A:HEM154 4.3 5.6 1.0 C3D A:HEM154 4.3 7.3 1.0 CG A:HIS97 4.3 4.1 0.6 C2C A:HEM154 4.3 2.0 1.0 C3C A:HEM154 4.4 9.1 1.0 C3B A:HEM154 4.4 1.4 1.0 C2D A:HEM154 4.4 9.8 1.0 CG2 A:VAL67 4.6 10.4 1.0 CD2 A:LEU93 4.7 24.9 1.0 NE2 A:HIS63 4.7 9.9 1.0

H.E.Harutyunyan, T.N.Safonova, I.P.Kuranova, A.N.Popov, A.V.Teplyakov, G.V.Obmolova, A.A.Rusakov, B.K.Vainshtein, G.G.Dodson, J.C.Wilson, M.F.Perutz. The Structure of Deoxy- and Oxy-Leghaemoglobin From Lupin J.Mol.Biol. V. 251 104 1995.
ISSN: ISSN 0022-2836
PubMed: 7643380
DOI: 10.1006/JMBI.1995.0419