Chlorine in PDB 8vmg: Crystal Structure of Gsk-3 26-383 Bound to Axin 383-435
Enzymatic activity of Crystal Structure of Gsk-3 26-383 Bound to Axin 383-435
All present enzymatic activity of Crystal Structure of Gsk-3 26-383 Bound to Axin 383-435:
2.7.11.1;
2.7.11.26;
Protein crystallography data
The structure of Crystal Structure of Gsk-3 26-383 Bound to Axin 383-435, PDB code: 8vmg
was solved by
M.D.Enos,
M.Gavagan,
N.Jameson,
J.G.Zalatan,
W.I.Weis,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
39.76 /
2.45
|
Space group
|
P 65 2 2
|
Cell size a, b, c (Å), α, β, γ (°)
|
195.585,
195.585,
152.204,
90,
90,
120
|
R / Rfree (%)
|
19.5 /
23
|
Other elements in 8vmg:
The structure of Crystal Structure of Gsk-3 26-383 Bound to Axin 383-435 also contains other interesting chemical elements:
Chlorine Binding Sites:
Pages:
>>> Page 1 <<<
Page 2, Binding sites: 11 -
15;
Binding sites:
The binding sites of Chlorine atom in the Crystal Structure of Gsk-3 26-383 Bound to Axin 383-435
(pdb code 8vmg). This binding sites where shown within
5.0 Angstroms radius around Chlorine atom.
In total 15 binding sites of Chlorine where determined in the
Crystal Structure of Gsk-3 26-383 Bound to Axin 383-435, PDB code: 8vmg:
Jump to Chlorine binding site number:
1;
2;
3;
4;
5;
6;
7;
8;
9;
10;
Chlorine binding site 1 out
of 15 in 8vmg
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Chlorine Binding Sites List in 8vmg
Chlorine binding site 1 out
of 15 in the Crystal Structure of Gsk-3 26-383 Bound to Axin 383-435
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 1 of Crystal Structure of Gsk-3 26-383 Bound to Axin 383-435 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cl437
b:85.6
occ:1.00
|
NE2
|
C:GLN400
|
3.5
|
69.2
|
1.0
|
N
|
A:GLN295
|
3.5
|
60.1
|
1.0
|
CA
|
A:PRO294
|
4.0
|
62.2
|
1.0
|
CB
|
A:GLN295
|
4.2
|
58.4
|
1.0
|
C
|
A:PRO294
|
4.3
|
59.0
|
1.0
|
CG
|
A:GLN295
|
4.3
|
61.4
|
1.0
|
CA
|
A:GLN295
|
4.4
|
58.3
|
1.0
|
CD
|
C:GLN400
|
4.6
|
74.2
|
1.0
|
CB
|
A:PRO294
|
4.6
|
59.4
|
1.0
|
OE1
|
C:GLN400
|
4.7
|
73.9
|
1.0
|
O
|
A:GLN295
|
4.7
|
67.0
|
1.0
|
|
Chlorine binding site 2 out
of 15 in 8vmg
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Chlorine Binding Sites List in 8vmg
Chlorine binding site 2 out
of 15 in the Crystal Structure of Gsk-3 26-383 Bound to Axin 383-435
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 2 of Crystal Structure of Gsk-3 26-383 Bound to Axin 383-435 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cl438
b:79.6
occ:1.00
|
O
|
A:HOH574
|
3.3
|
70.7
|
1.0
|
NZ
|
A:LYS183
|
3.7
|
68.7
|
1.0
|
CG
|
A:GLN185
|
3.9
|
60.4
|
1.0
|
CB
|
A:GLN185
|
3.9
|
57.7
|
1.0
|
O
|
A:HOH561
|
4.0
|
82.3
|
1.0
|
O
|
A:HOH558
|
4.1
|
82.6
|
1.0
|
CD
|
A:GLN185
|
4.6
|
59.7
|
1.0
|
MG
|
A:MG436
|
4.7
|
73.5
|
1.0
|
CD
|
A:LYS183
|
4.7
|
62.6
|
1.0
|
CE
|
A:LYS183
|
4.8
|
65.9
|
1.0
|
O3
|
A:SO4434
|
4.8
|
95.0
|
1.0
|
|
Chlorine binding site 3 out
of 15 in 8vmg
Go back to
Chlorine Binding Sites List in 8vmg
Chlorine binding site 3 out
of 15 in the Crystal Structure of Gsk-3 26-383 Bound to Axin 383-435
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 3 of Crystal Structure of Gsk-3 26-383 Bound to Axin 383-435 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cl439
b:106.6
occ:1.00
|
N
|
A:ARG209
|
3.5
|
77.8
|
1.0
|
CG
|
A:ARG209
|
3.7
|
110.8
|
1.0
|
CB
|
A:ARG209
|
4.1
|
93.8
|
1.0
|
CG1
|
A:VAL208
|
4.1
|
78.9
|
1.0
|
CA
|
A:VAL208
|
4.1
|
75.2
|
1.0
|
CD
|
A:ARG209
|
4.3
|
125.2
|
1.0
|
C
|
A:VAL208
|
4.3
|
77.6
|
1.0
|
CA
|
A:ARG209
|
4.4
|
85.2
|
1.0
|
O
|
A:LEU207
|
4.6
|
70.9
|
1.0
|
CB
|
A:VAL208
|
4.7
|
80.6
|
1.0
|
|
Chlorine binding site 4 out
of 15 in 8vmg
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Chlorine Binding Sites List in 8vmg
Chlorine binding site 4 out
of 15 in the Crystal Structure of Gsk-3 26-383 Bound to Axin 383-435
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 4 of Crystal Structure of Gsk-3 26-383 Bound to Axin 383-435 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cl440
b:117.5
occ:1.00
|
NH2
|
A:ARG278
|
3.1
|
95.3
|
1.0
|
NH1
|
A:ARG282
|
3.4
|
108.2
|
1.0
|
NH2
|
A:ARG282
|
3.8
|
100.2
|
1.0
|
CZ
|
A:ARG282
|
4.1
|
110.9
|
1.0
|
CZ
|
A:ARG278
|
4.3
|
99.8
|
1.0
|
NE
|
A:ARG278
|
4.8
|
86.1
|
1.0
|
|
Chlorine binding site 5 out
of 15 in 8vmg
Go back to
Chlorine Binding Sites List in 8vmg
Chlorine binding site 5 out
of 15 in the Crystal Structure of Gsk-3 26-383 Bound to Axin 383-435
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 5 of Crystal Structure of Gsk-3 26-383 Bound to Axin 383-435 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cl441
b:79.0
occ:1.00
|
OE1
|
A:GLU322
|
3.4
|
63.8
|
1.0
|
NE2
|
A:GLN280
|
3.5
|
50.2
|
1.0
|
CD2
|
A:TYR323
|
3.6
|
50.6
|
1.0
|
N
|
A:TYR323
|
3.7
|
44.0
|
1.0
|
CA
|
A:GLU322
|
4.0
|
51.0
|
1.0
|
O
|
A:LEU321
|
4.1
|
49.5
|
1.0
|
CE2
|
A:TYR323
|
4.3
|
56.4
|
1.0
|
CG
|
A:TYR323
|
4.4
|
50.8
|
1.0
|
C
|
A:GLU322
|
4.4
|
49.2
|
1.0
|
CD
|
A:GLU322
|
4.5
|
67.9
|
1.0
|
CB
|
A:TYR323
|
4.5
|
49.0
|
1.0
|
CD
|
A:GLN280
|
4.6
|
60.2
|
1.0
|
O
|
A:HOH580
|
4.6
|
57.6
|
1.0
|
CB
|
A:GLU322
|
4.7
|
49.2
|
1.0
|
CA
|
A:TYR323
|
4.7
|
50.4
|
1.0
|
CD1
|
A:LEU273
|
4.8
|
50.0
|
1.0
|
OE1
|
A:GLN280
|
4.9
|
60.1
|
1.0
|
CB
|
A:LEU273
|
4.9
|
47.0
|
1.0
|
C
|
A:LEU321
|
5.0
|
49.2
|
1.0
|
N
|
A:GLU322
|
5.0
|
45.6
|
1.0
|
|
Chlorine binding site 6 out
of 15 in 8vmg
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Chlorine Binding Sites List in 8vmg
Chlorine binding site 6 out
of 15 in the Crystal Structure of Gsk-3 26-383 Bound to Axin 383-435
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 6 of Crystal Structure of Gsk-3 26-383 Bound to Axin 383-435 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Cl423
b:102.8
occ:1.00
|
N
|
B:PHE360
|
3.4
|
83.8
|
1.0
|
N
|
B:LEU359
|
3.4
|
88.2
|
1.0
|
CA
|
B:ALA358
|
3.7
|
91.4
|
1.0
|
CB
|
B:ALA358
|
4.0
|
83.2
|
1.0
|
CD2
|
B:PHE360
|
4.0
|
88.4
|
1.0
|
N
|
B:ASN361
|
4.0
|
92.3
|
1.0
|
C
|
B:ALA358
|
4.0
|
87.2
|
1.0
|
CA
|
B:PHE360
|
4.1
|
89.2
|
1.0
|
CB
|
B:PHE360
|
4.2
|
89.1
|
1.0
|
C
|
B:PHE360
|
4.2
|
93.3
|
1.0
|
C
|
B:LEU359
|
4.3
|
78.0
|
1.0
|
CG
|
B:PHE360
|
4.4
|
81.9
|
1.0
|
CA
|
B:LEU359
|
4.4
|
76.9
|
1.0
|
OD1
|
B:ASN361
|
4.6
|
96.3
|
1.0
|
CB
|
B:ASN361
|
4.6
|
103.3
|
1.0
|
CG
|
B:ASN361
|
4.7
|
101.5
|
1.0
|
CE2
|
B:PHE360
|
4.8
|
91.8
|
1.0
|
CA
|
B:ASN361
|
4.9
|
98.0
|
1.0
|
N
|
B:ALA358
|
5.0
|
90.5
|
1.0
|
|
Chlorine binding site 7 out
of 15 in 8vmg
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Chlorine Binding Sites List in 8vmg
Chlorine binding site 7 out
of 15 in the Crystal Structure of Gsk-3 26-383 Bound to Axin 383-435
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 7 of Crystal Structure of Gsk-3 26-383 Bound to Axin 383-435 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Cl424
b:120.4
occ:1.00
|
NH2
|
B:ARG306
|
3.3
|
133.8
|
1.0
|
N
|
B:THR152
|
3.5
|
92.1
|
1.0
|
CG2
|
B:THR152
|
3.5
|
90.6
|
1.0
|
CB
|
B:THR152
|
4.0
|
98.2
|
1.0
|
CA
|
B:GLN151
|
4.2
|
90.8
|
1.0
|
CA
|
B:THR152
|
4.3
|
95.9
|
1.0
|
C
|
B:GLN151
|
4.4
|
83.6
|
1.0
|
CB
|
B:GLN151
|
4.4
|
91.8
|
1.0
|
O
|
B:THR152
|
4.6
|
85.9
|
1.0
|
CZ
|
B:ARG306
|
4.6
|
126.3
|
1.0
|
CG
|
B:GLN151
|
4.9
|
102.7
|
1.0
|
C
|
B:THR152
|
4.9
|
85.6
|
1.0
|
HO2
|
B:EDO402
|
4.9
|
102.7
|
1.0
|
|
Chlorine binding site 8 out
of 15 in 8vmg
Go back to
Chlorine Binding Sites List in 8vmg
Chlorine binding site 8 out
of 15 in the Crystal Structure of Gsk-3 26-383 Bound to Axin 383-435
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 8 of Crystal Structure of Gsk-3 26-383 Bound to Axin 383-435 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Cl425
b:87.4
occ:1.00
|
N
|
B:ARG308
|
3.5
|
62.0
|
1.0
|
CB
|
B:ARG308
|
3.5
|
71.7
|
1.0
|
CD
|
B:ARG308
|
3.6
|
98.8
|
1.0
|
CG
|
B:ARG308
|
3.6
|
81.5
|
1.0
|
CG
|
B:PRO307
|
3.8
|
63.9
|
1.0
|
CD
|
B:PRO307
|
3.8
|
56.1
|
1.0
|
N
|
B:PRO307
|
4.0
|
61.0
|
1.0
|
CB
|
B:ARG306
|
4.1
|
63.4
|
1.0
|
NE
|
B:ARG306
|
4.1
|
113.9
|
1.0
|
CA
|
B:ARG308
|
4.2
|
63.0
|
1.0
|
NE
|
B:ARG308
|
4.2
|
123.6
|
1.0
|
CD
|
B:ARG306
|
4.3
|
101.2
|
1.0
|
CZ
|
B:ARG306
|
4.4
|
126.3
|
1.0
|
C
|
B:PRO307
|
4.5
|
63.0
|
1.0
|
C
|
B:ARG306
|
4.5
|
66.3
|
1.0
|
CB
|
B:PRO307
|
4.6
|
64.3
|
1.0
|
CA
|
B:PRO307
|
4.6
|
74.3
|
1.0
|
CZ
|
B:ARG308
|
4.8
|
131.8
|
1.0
|
NH2
|
B:ARG306
|
4.8
|
133.8
|
1.0
|
NH1
|
B:ARG306
|
4.8
|
106.3
|
1.0
|
CG
|
B:ARG306
|
4.8
|
104.1
|
1.0
|
NH1
|
B:ARG308
|
4.9
|
127.4
|
1.0
|
CA
|
B:ARG306
|
4.9
|
63.0
|
1.0
|
|
Chlorine binding site 9 out
of 15 in 8vmg
Go back to
Chlorine Binding Sites List in 8vmg
Chlorine binding site 9 out
of 15 in the Crystal Structure of Gsk-3 26-383 Bound to Axin 383-435
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 9 of Crystal Structure of Gsk-3 26-383 Bound to Axin 383-435 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Cl426
b:123.2
occ:1.00
|
OD2
|
B:ASP233
|
3.0
|
102.4
|
1.0
|
O
|
B:GLU283
|
3.6
|
81.0
|
1.0
|
CG
|
B:ASP233
|
3.7
|
95.7
|
1.0
|
OD1
|
B:ASP233
|
3.9
|
89.0
|
1.0
|
O
|
B:MET284
|
4.3
|
75.6
|
1.0
|
C
|
B:GLU283
|
4.6
|
84.9
|
1.0
|
CD
|
B:PRO286
|
4.7
|
100.4
|
1.0
|
O
|
B:ARG282
|
4.7
|
102.4
|
1.0
|
CB
|
B:ASP233
|
4.8
|
84.2
|
1.0
|
CG
|
B:PRO286
|
4.8
|
107.0
|
1.0
|
O
|
B:ASP233
|
4.9
|
83.3
|
1.0
|
C
|
B:MET284
|
5.0
|
86.5
|
1.0
|
|
Chlorine binding site 10 out
of 15 in 8vmg
Go back to
Chlorine Binding Sites List in 8vmg
Chlorine binding site 10 out
of 15 in the Crystal Structure of Gsk-3 26-383 Bound to Axin 383-435
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 10 of Crystal Structure of Gsk-3 26-383 Bound to Axin 383-435 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Cl427
b:105.0
occ:1.00
|
N
|
B:GLN295
|
3.9
|
102.1
|
1.0
|
NE2
|
D:GLN400
|
3.9
|
121.7
|
1.0
|
CA
|
B:PRO294
|
4.4
|
99.8
|
1.0
|
CB
|
B:GLN295
|
4.4
|
100.4
|
1.0
|
C
|
B:PRO294
|
4.7
|
103.9
|
1.0
|
CA
|
B:GLN295
|
4.7
|
104.4
|
1.0
|
CG
|
B:GLN295
|
4.7
|
101.1
|
1.0
|
O
|
B:GLN295
|
4.8
|
95.2
|
1.0
|
CB
|
B:PRO294
|
4.8
|
100.2
|
1.0
|
OE1
|
D:GLN400
|
4.8
|
123.7
|
1.0
|
CD
|
D:GLN400
|
4.9
|
116.8
|
1.0
|
|
Reference:
M.D.Enos,
M.Gavagan,
N.Jameson,
J.G.Zalatan,
W.I.Weis.
Structural and Functional Effects of Phosphopriming and Scaffolding in the Kinase GSK3BETA Sci.Signal. 2024.
ISSN: ESSN 1937-9145
DOI: 10.1126/SCISIGNAL.ADO0881
Page generated: Sat Sep 28 19:35:02 2024
|