Zinc in PDB 6gnq: Monoclinic Crystalline Form of Human Insulin, Complexed with Meta- Cresol

The structure of Monoclinic Crystalline Form of Human Insulin, Complexed with Meta- Cresol, PDB code: 6gnq was solved by I.Margiolaki, F.Karavassili, A.Valmas, M.Dimarogona, A.E.Giannopoulou, S.Fili, G.Schluckebier, M.Norrman, D.Beckers, A.N.Fitch, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	81.78 / 2.20
Space group	P 1 21 1
Cell size a, b, c (Å), α, β, γ (°)	47.662, 70.361, 84.748, 90.00, 105.21, 90.00
R / Rfree (%)	22.3 / 27.9

The binding sites of Zinc atom in the Monoclinic Crystalline Form of Human Insulin, Complexed with Meta- Cresol (pdb code 6gnq). This binding sites where shown within 5.0 Angstroms radius around Zinc atom.
In total 4 binding sites of Zinc where determined in the Monoclinic Crystalline Form of Human Insulin, Complexed with Meta- Cresol, PDB code: 6gnq:
Jump to Zinc binding site number: 1; 2; 3; 4;

Zinc binding site 1 out of 4 in the Monoclinic Crystalline Form of Human Insulin, Complexed with Meta- Cresol


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 1 of Monoclinic Crystalline Form of Human Insulin, Complexed with Meta- Cresol within 5.0Å range: probe atom residue distance (Å) B Occ B:Zn101 b:22.3 occ:1.00 NE2 L:HIS10 1.9 21.8 1.0 NE2 B:HIS10 2.0 21.4 1.0 NE2 J:HIS10 2.0 20.9 1.0 S B:IS8102 2.1 49.6 1.0 CE1 L:HIS10 2.8 22.8 1.0 CE1 B:HIS10 2.9 21.8 1.0 CE1 J:HIS10 3.0 21.1 1.0 CD2 J:HIS10 3.0 20.8 1.0 CD2 L:HIS10 3.0 22.2 1.0 CD2 B:HIS10 3.1 21.1 1.0 C B:IS8102 3.8 46.4 1.0 ND1 L:HIS10 4.0 22.2 1.0 ND1 B:HIS10 4.1 22.0 1.0 ND1 J:HIS10 4.1 20.6 1.0 CG L:HIS10 4.1 22.3 1.0 CG J:HIS10 4.1 20.9 1.0 CG B:HIS10 4.2 21.9 1.0 O J:LEU6 4.7 23.6 1.0 O L:LEU6 4.7 27.2 1.0 O B:LEU6 4.8 28.1 1.0 CB J:LEU6 4.9 25.4 1.0 N B:IS8102 5.0 44.3 1.0

Zinc binding site 2 out of 4 in the Monoclinic Crystalline Form of Human Insulin, Complexed with Meta- Cresol


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 2 of Monoclinic Crystalline Form of Human Insulin, Complexed with Meta- Cresol within 5.0Å range: probe atom residue distance (Å) B Occ D:Zn101 b:19.6 occ:1.00 NE2 H:HIS10 1.9 20.3 1.0 NE2 F:HIS10 2.0 21.3 1.0 NE2 D:HIS10 2.0 21.7 1.0 S D:IS8103 2.1 39.4 1.0 CE1 H:HIS10 2.9 21.1 1.0 CE1 D:HIS10 2.9 21.2 1.0 CE1 F:HIS10 2.9 21.7 1.0 CD2 H:HIS10 3.0 20.9 1.0 CD2 F:HIS10 3.0 22.3 1.0 CD2 D:HIS10 3.0 21.0 1.0 C D:IS8103 3.7 37.5 1.0 ND1 H:HIS10 4.0 21.1 1.0 ND1 F:HIS10 4.0 21.9 1.0 ND1 D:HIS10 4.0 21.1 1.0 CG H:HIS10 4.1 21.0 1.0 CG F:HIS10 4.1 21.9 1.0 CG D:HIS10 4.1 21.9 1.0 O H:LEU6 4.7 31.7 1.0 O F:LEU6 4.7 27.6 1.0 O D:LEU6 4.8 27.7 1.0 CB D:LEU6 4.9 29.9 1.0 N D:IS8103 4.9 36.1 1.0 CB H:LEU6 4.9 33.0 1.0

Zinc binding site 3 out of 4 in the Monoclinic Crystalline Form of Human Insulin, Complexed with Meta- Cresol


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 3 of Monoclinic Crystalline Form of Human Insulin, Complexed with Meta- Cresol within 5.0Å range: probe atom residue distance (Å) B Occ N:Zn101 b:27.0 occ:1.00 NE2 X:HIS10 1.9 25.7 1.0 S N:IS8102 2.0 48.1 1.0 NE2 V:HIS10 2.0 23.4 1.0 NE2 N:HIS10 2.1 26.7 1.0 CE1 X:HIS10 2.9 27.0 1.0 CE1 V:HIS10 2.9 24.1 1.0 CD2 N:HIS10 3.0 26.1 1.0 CD2 X:HIS10 3.0 26.7 1.0 CD2 V:HIS10 3.1 23.7 1.0 CE1 N:HIS10 3.1 26.4 1.0 C N:IS8102 3.6 48.4 1.0 ND1 X:HIS10 4.0 27.4 1.0 ND1 V:HIS10 4.1 23.0 1.0 CG X:HIS10 4.1 27.5 1.0 CG V:HIS10 4.2 23.3 1.0 CG N:HIS10 4.2 25.9 1.0 ND1 N:HIS10 4.2 26.3 1.0 O N:LEU6 4.7 32.1 1.0 O X:LEU6 4.8 36.6 1.0 N N:IS8102 4.8 46.4 1.0 O V:LEU6 4.8 31.3 1.0 CB X:LEU6 5.0 38.6 1.0

Zinc binding site 4 out of 4 in the Monoclinic Crystalline Form of Human Insulin, Complexed with Meta- Cresol


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 4 of Monoclinic Crystalline Form of Human Insulin, Complexed with Meta- Cresol within 5.0Å range: probe atom residue distance (Å) B Occ P:Zn101 b:24.6 occ:1.00 NE2 T:HIS10 2.0 22.9 1.0 S P:IS8103 2.0 46.7 1.0 NE2 P:HIS10 2.1 22.7 1.0 NE2 R:HIS10 2.1 27.1 1.0 CE1 T:HIS10 2.9 23.4 1.0 CD2 T:HIS10 3.0 23.5 1.0 CD2 P:HIS10 3.0 23.0 1.0 CE1 R:HIS10 3.0 27.3 1.0 CE1 P:HIS10 3.0 23.3 1.0 CD2 R:HIS10 3.1 27.0 1.0 C P:IS8103 3.7 42.7 1.0 ND1 T:HIS10 4.0 23.2 1.0 CG T:HIS10 4.1 23.4 1.0 ND1 R:HIS10 4.1 27.4 1.0 ND1 P:HIS10 4.2 23.1 1.0 CG P:HIS10 4.2 23.9 1.0 CG R:HIS10 4.2 27.1 1.0 O T:LEU6 4.7 32.5 1.0 O R:LEU6 4.7 32.1 1.0 O P:LEU6 4.7 28.0 1.0 CB P:LEU6 4.9 31.4 1.0 N P:IS8103 4.9 39.0 1.0 CB T:LEU6 5.0 37.2 1.0

I.Margiolaki, F.Karavassili, A.Valmas, M.Dimarogona, A.E.Giannopoulou, S.Fili, G.Schluckebier, M.Norrman, D.Beckers, A.N.Fitch. Monoclinic Crystalline Form of Human Insulin, Complexed with Meta-Cresol To Be Published.