Atomistry » Chlorine » PDB 6ttk-6u4j » 6tw2
Atomistry »
  Chlorine »
    PDB 6ttk-6u4j »
      6tw2 »

Chlorine in PDB 6tw2: Re-Refined Crystal Structure of Di-Phosphorylated Human CLK1 in Complex with A Novel Substituted Indole Inhibitor

Enzymatic activity of Re-Refined Crystal Structure of Di-Phosphorylated Human CLK1 in Complex with A Novel Substituted Indole Inhibitor

All present enzymatic activity of Re-Refined Crystal Structure of Di-Phosphorylated Human CLK1 in Complex with A Novel Substituted Indole Inhibitor:
2.7.12.1;

Protein crystallography data

The structure of Re-Refined Crystal Structure of Di-Phosphorylated Human CLK1 in Complex with A Novel Substituted Indole Inhibitor, PDB code: 6tw2 was solved by B.Loll, T.Haltenhof, F.Heyd, M.C.Wahl, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 29.27 / 1.80
Space group C 1 2 1
Cell size a, b, c (Å), α, β, γ (°) 90.950, 64.108, 78.894, 90.00, 118.17, 90.00
R / Rfree (%) 18.1 / 22.3

Chlorine Binding Sites:

The binding sites of Chlorine atom in the Re-Refined Crystal Structure of Di-Phosphorylated Human CLK1 in Complex with A Novel Substituted Indole Inhibitor (pdb code 6tw2). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 2 binding sites of Chlorine where determined in the Re-Refined Crystal Structure of Di-Phosphorylated Human CLK1 in Complex with A Novel Substituted Indole Inhibitor, PDB code: 6tw2:
Jump to Chlorine binding site number: 1; 2;

Chlorine binding site 1 out of 2 in 6tw2

Go back to Chlorine Binding Sites List in 6tw2
Chlorine binding site 1 out of 2 in the Re-Refined Crystal Structure of Di-Phosphorylated Human CLK1 in Complex with A Novel Substituted Indole Inhibitor


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of Re-Refined Crystal Structure of Di-Phosphorylated Human CLK1 in Complex with A Novel Substituted Indole Inhibitor within 5.0Å range:
probe atom residue distance (Å) B Occ
E:Cl2301

b:45.5
occ:1.00
CL1 E:V252301 0.0 45.5 1.0
CAQ E:V252301 1.8 21.5 1.0
CAP E:V252301 2.7 23.5 1.0
CAU E:V252301 2.8 22.3 1.0
CL2 E:V252301 3.0 26.2 1.0
CAB E:V252301 3.2 28.8 1.0
NAV E:V252301 3.4 24.1 1.0
CB E:ALA189 3.6 23.1 1.0
CD1 E:LEU167 3.7 28.3 1.0
O E:LEU244 3.8 41.3 1.0
CD2 E:LEU295 4.0 23.6 1.0
N E:LEU244 4.0 28.0 1.0
CAJ E:V252301 4.0 25.7 1.0
CAT E:V252301 4.1 15.1 1.0
CG1 E:VAL175 4.2 24.5 1.0
CB E:LEU244 4.3 28.6 1.0
C E:LEU244 4.3 38.1 1.0
CA E:LEU244 4.4 33.8 1.0
CD1 E:LEU243 4.5 35.1 1.0
CAK E:V252301 4.5 18.1 1.0
CAS E:V252301 4.7 19.8 1.0
CB E:LEU167 4.8 23.8 1.0
CG E:LEU167 4.8 24.7 1.0
O E:GLY245 4.8 32.3 1.0

Chlorine binding site 2 out of 2 in 6tw2

Go back to Chlorine Binding Sites List in 6tw2
Chlorine binding site 2 out of 2 in the Re-Refined Crystal Structure of Di-Phosphorylated Human CLK1 in Complex with A Novel Substituted Indole Inhibitor


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 2 of Re-Refined Crystal Structure of Di-Phosphorylated Human CLK1 in Complex with A Novel Substituted Indole Inhibitor within 5.0Å range:
probe atom residue distance (Å) B Occ
E:Cl2301

b:26.2
occ:1.00
CL2 E:V252301 0.0 26.2 1.0
CAP E:V252301 1.8 23.5 1.0
CAQ E:V252301 2.7 21.5 1.0
CAJ E:V252301 2.7 25.7 1.0
O E:GLU242 2.9 32.9 0.5
O E:GLU242 3.0 33.0 0.5
CL1 E:V252301 3.0 45.5 1.0
CB E:PHE241 3.5 25.9 1.0
CB E:ALA189 3.5 23.1 1.0
N E:LEU244 3.7 28.0 1.0
CG E:LEU244 3.7 28.3 1.0
CD1 E:LEU244 3.9 22.9 1.0
CB E:LEU244 3.9 28.6 1.0
CAK E:V252301 4.0 18.1 1.0
CG2 E:VAL225 4.0 45.7 1.0
CAU E:V252301 4.0 22.3 1.0
C E:GLU242 4.1 31.7 0.5
C E:GLU242 4.1 31.5 0.5
CG E:PHE241 4.2 26.1 1.0
C E:LEU243 4.3 28.7 1.0
CA E:LEU244 4.4 33.8 1.0
CA E:LEU243 4.4 25.7 1.0
CD2 E:PHE241 4.5 27.9 1.0
CAT E:V252301 4.5 15.1 1.0
CD2 E:LEU295 4.7 23.6 1.0
C E:PHE241 4.8 27.6 1.0
N E:LEU243 4.8 25.6 1.0
CA E:PHE241 4.8 22.7 1.0
O E:PHE241 4.9 25.4 1.0
CA E:ALA189 4.9 23.9 1.0

Reference:

T.Haltenhof, A.Kote, F.De Bortoli, S.Schiefer, S.Meinike, K.Emmerichs, K.K.Petermann, B.Timmermann, P.Imhof, A.Franz, B.Loll, M.C.Wahl, M.Preussner, F.Heyd. A Conserved Kinase-Based Body Temperature Sensor Globally Controls Alternative Splicing and Gene Expression To Be Published.
Page generated: Mon Jul 29 15:37:33 2024

Last articles

Cl in 3UZ5
Cl in 3UXD
Cl in 3UY9
Cl in 3UZC
Cl in 3UXH
Cl in 3UXE
Cl in 3UX0
Cl in 3UWT
Cl in 3UUW
Cl in 3UWD
© Copyright 2008-2020 by atomistry.com
Home   |    Site Map   |    Copyright   |    Contact us   |    Privacy