Atomistry » Zinc » PDB 5h6b-5ho1 » 5hez
Atomistry »
  Zinc »
    PDB 5h6b-5ho1 »
      5hez »

Zinc in PDB 5hez: JAK2 Kinase (JH1 Domain) Mutant P1057A in Complex with TG101209

Enzymatic activity of JAK2 Kinase (JH1 Domain) Mutant P1057A in Complex with TG101209

All present enzymatic activity of JAK2 Kinase (JH1 Domain) Mutant P1057A in Complex with TG101209:
2.7.10.2;

Protein crystallography data

The structure of JAK2 Kinase (JH1 Domain) Mutant P1057A in Complex with TG101209, PDB code: 5hez was solved by M.Ultsch, C.Eigenbrot, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 26.81 / 2.66
Space group C 2 2 2
Cell size a, b, c (Å), α, β, γ (°) 211.813, 215.649, 91.497, 90.00, 90.00, 90.00
R / Rfree (%) 21.7 / 23.8

Other elements in 5hez:

The structure of JAK2 Kinase (JH1 Domain) Mutant P1057A in Complex with TG101209 also contains other interesting chemical elements:

Chlorine (Cl) 3 atoms

Zinc Binding Sites:

The binding sites of Zinc atom in the JAK2 Kinase (JH1 Domain) Mutant P1057A in Complex with TG101209 (pdb code 5hez). This binding sites where shown within 5.0 Angstroms radius around Zinc atom.
In total 2 binding sites of Zinc where determined in the JAK2 Kinase (JH1 Domain) Mutant P1057A in Complex with TG101209, PDB code: 5hez:
Jump to Zinc binding site number: 1; 2;

Zinc binding site 1 out of 2 in 5hez

Go back to Zinc Binding Sites List in 5hez
Zinc binding site 1 out of 2 in the JAK2 Kinase (JH1 Domain) Mutant P1057A in Complex with TG101209


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 1 of JAK2 Kinase (JH1 Domain) Mutant P1057A in Complex with TG101209 within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Zn1202

b:55.0
occ:1.00
NE2 A:HIS891 2.1 52.1 1.0
ND1 A:HIS886 2.1 60.3 1.0
CD2 A:HIS891 3.0 52.5 1.0
CE1 A:HIS886 3.1 60.1 1.0
CE1 A:HIS891 3.1 52.2 1.0
CG A:HIS886 3.2 58.1 1.0
CB A:HIS886 3.5 53.9 1.0
CG A:HIS891 4.2 52.3 1.0
ND1 A:HIS891 4.2 53.6 1.0
NE2 A:HIS886 4.2 60.3 1.0
CD2 A:HIS886 4.3 59.6 1.0
CG2 A:THR888 4.9 59.7 1.0
OG1 A:THR888 4.9 58.5 1.0
CA A:HIS886 4.9 53.5 1.0

Zinc binding site 2 out of 2 in 5hez

Go back to Zinc Binding Sites List in 5hez
Zinc binding site 2 out of 2 in the JAK2 Kinase (JH1 Domain) Mutant P1057A in Complex with TG101209


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 2 of JAK2 Kinase (JH1 Domain) Mutant P1057A in Complex with TG101209 within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Zn1204

b:54.2
occ:1.00
NE2 C:HIS891 1.9 52.8 1.0
ND1 C:HIS886 2.1 56.0 1.0
ND1 B:HIS886 2.1 61.0 1.0
NE2 B:HIS891 2.2 57.2 1.0
CD2 C:HIS891 2.9 52.9 1.0
CE1 C:HIS891 3.0 53.2 1.0
CE1 C:HIS886 3.0 55.9 1.0
CE1 B:HIS886 3.0 61.4 1.0
CD2 B:HIS891 3.1 56.9 1.0
CG C:HIS886 3.1 53.5 1.0
CG B:HIS886 3.2 58.3 1.0
CE1 B:HIS891 3.2 57.1 1.0
CB C:HIS886 3.5 49.4 1.0
CB B:HIS886 3.5 53.6 1.0
CG C:HIS891 4.0 52.2 1.0
ND1 C:HIS891 4.1 54.4 1.0
NE2 C:HIS886 4.2 55.7 1.0
NE2 B:HIS886 4.2 61.8 1.0
CG B:HIS891 4.3 55.2 1.0
CD2 C:HIS886 4.3 54.7 1.0
CD2 B:HIS886 4.3 60.8 1.0
ND1 B:HIS891 4.3 57.4 1.0
OG1 C:THR888 4.8 67.0 1.0
CA C:HIS886 4.9 48.6 1.0
CG2 C:THR888 4.9 63.7 1.0
CG2 B:THR888 5.0 53.1 1.0
CA B:HIS886 5.0 52.1 1.0

Reference:

C.A.Dendrou, A.Cortes, L.Shipman, H.G.Evans, K.E.Attfield, L.Jostins, T.Barber, G.Kaur, S.B.Kuttikkatte, O.A.Leach, C.Desel, S.L.Faergeman, J.Cheeseman, M.J.Neville, S.Sawcer, A.Compston, A.R.Johnson, C.Everett, J.I.Bell, F.Karpe, M.Ultsch, C.Eigenbrot, G.Mcvean, L.Fugger. Resolving TYK2 Locus Genotype-to-Phenotype Differences in Autoimmunity. Sci Transl Med V. 8 RA149 2016.
ISSN: ESSN 1946-6242
PubMed: 27807284
DOI: 10.1126/SCITRANSLMED.AAG1974
Page generated: Wed Dec 16 06:20:18 2020

Last articles

Zn in 8WB0
Zn in 8WAX
Zn in 8WAU
Zn in 8WAZ
Zn in 8WAY
Zn in 8WAV
Zn in 8WAW
Zn in 8WAT
Zn in 8W7M
Zn in 8WD3
© Copyright 2008-2020 by atomistry.com
Home   |    Site Map   |    Copyright   |    Contact us   |    Privacy