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Chlorine in PDB 5mo4: ABL1 Kinase (T334I_D382N) in Complex with Asciminib and Nilotinib
Enzymatic activity of ABL1 Kinase (T334I_D382N) in Complex with Asciminib and Nilotinib
All present enzymatic activity of ABL1 Kinase (T334I_D382N) in Complex with Asciminib and Nilotinib:
2.7.10.2;
2.7.10.2;
Protein crystallography data
The structure of ABL1 Kinase (T334I_D382N) in Complex with Asciminib and Nilotinib, PDB code: 5mo4
was solved by
S.W.Cowan-Jacob,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
| Resolution Low / High (Å) | 59.14 / 2.17 |
| Space group | C 2 2 21 |
| Cell size a, b, c (Å), α, β, γ (°) | 118.280, 124.130, 74.660, 90.00, 90.00, 90.00 |
| R / Rfree (%) | 18.2 / 21.7 |
Other elements in 5mo4:
The structure of ABL1 Kinase (T334I_D382N) in Complex with Asciminib and Nilotinib also contains other interesting chemical elements:
| Fluorine | (F) | 5 atoms |
Chlorine Binding Sites:
The binding sites of Chlorine atom in the ABL1 Kinase (T334I_D382N) in Complex with Asciminib and Nilotinib
(pdb code 5mo4). This binding sites where shown within
5.0 Angstroms radius around Chlorine atom.
In total only one binding site of Chlorine was determined in the ABL1 Kinase (T334I_D382N) in Complex with Asciminib and Nilotinib, PDB code: 5mo4:
In total only one binding site of Chlorine was determined in the ABL1 Kinase (T334I_D382N) in Complex with Asciminib and Nilotinib, PDB code: 5mo4:
Chlorine binding site 1 out of 1 in 5mo4
Go back to
Chlorine Binding Sites List in 5mo4
Chlorine binding site 1 out
of 1 in the ABL1 Kinase (T334I_D382N) in Complex with Asciminib and Nilotinib
Mono view
Stereo pair view
Mono view
Stereo pair view
A full contact list of Chlorine with other atoms in the Cl binding
site number 1 of ABL1 Kinase (T334I_D382N) in Complex with Asciminib and Nilotinib within 5.0Å range:
|
Reference:
A.A.Wylie,
J.Schoepfer,
W.Jahnke,
S.W.Cowan-Jacob,
A.Loo,
P.Furet,
A.L.Marzinzik,
X.Pelle,
J.Donovan,
W.Zhu,
S.Buonamici,
A.Q.Hassan,
F.Lombardo,
V.Iyer,
M.Palmer,
G.Berellini,
S.Dodd,
S.Thohan,
H.Bitter,
S.Branford,
D.M.Ross,
T.P.Hughes,
L.Petruzzelli,
K.G.Vanasse,
M.Warmuth,
F.Hofmann,
N.J.Keen,
W.R.Sellers.
The Allosteric Inhibitor ABL001 Enables Dual Targeting of Bcr-ABL1. Nature V. 543 733 2017.
ISSN: ESSN 1476-4687
PubMed: 28329763
DOI: 10.1038/NATURE21702
Page generated: Fri Jul 26 12:48:41 2024
ISSN: ESSN 1476-4687
PubMed: 28329763
DOI: 10.1038/NATURE21702
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