Sodium in PDB 4mkk: Crystal Structure of C115A Mutant L-Methionine Gamma-Lyase From Citrobacter Freundii Modified By Allicine
Enzymatic activity of Crystal Structure of C115A Mutant L-Methionine Gamma-Lyase From Citrobacter Freundii Modified By Allicine
All present enzymatic activity of Crystal Structure of C115A Mutant L-Methionine Gamma-Lyase From Citrobacter Freundii Modified By Allicine:
4.4.1.11;
Protein crystallography data
The structure of Crystal Structure of C115A Mutant L-Methionine Gamma-Lyase From Citrobacter Freundii Modified By Allicine, PDB code: 4mkk
was solved by
S.V.Revtovich,
A.D.Nikulin,
E.A.Morozova,
L.N.Zakomirdina,
T.V.Demidkina,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
35.00 /
1.45
|
Space group
|
I 2 2 2
|
Cell size a, b, c (Å), α, β, γ (°)
|
56.690,
122.860,
128.600,
90.00,
90.00,
90.00
|
R / Rfree (%)
|
13.8 /
17.3
|
Other elements in 4mkk:
The structure of Crystal Structure of C115A Mutant L-Methionine Gamma-Lyase From Citrobacter Freundii Modified By Allicine also contains other interesting chemical elements:
Sodium Binding Sites:
The binding sites of Sodium atom in the Crystal Structure of C115A Mutant L-Methionine Gamma-Lyase From Citrobacter Freundii Modified By Allicine
(pdb code 4mkk). This binding sites where shown within
5.0 Angstroms radius around Sodium atom.
In total 5 binding sites of Sodium where determined in the
Crystal Structure of C115A Mutant L-Methionine Gamma-Lyase From Citrobacter Freundii Modified By Allicine, PDB code: 4mkk:
Jump to Sodium binding site number:
1;
2;
3;
4;
5;
Sodium binding site 1 out
of 5 in 4mkk
Go back to
Sodium Binding Sites List in 4mkk
Sodium binding site 1 out
of 5 in the Crystal Structure of C115A Mutant L-Methionine Gamma-Lyase From Citrobacter Freundii Modified By Allicine
Mono view
Stereo pair view
|
A full contact list of Sodium with other atoms in the Na binding
site number 1 of Crystal Structure of C115A Mutant L-Methionine Gamma-Lyase From Citrobacter Freundii Modified By Allicine within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Na403
b:26.2
occ:1.00
|
OD1
|
A:ASP342
|
2.7
|
19.3
|
1.0
|
OG
|
A:SER339
|
2.9
|
12.3
|
0.5
|
O
|
A:THR209
|
2.9
|
11.8
|
1.0
|
O
|
A:HOH514
|
3.4
|
13.2
|
1.0
|
CG
|
A:ASP342
|
3.6
|
18.0
|
1.0
|
OD2
|
A:ASP342
|
3.7
|
21.1
|
1.0
|
CB
|
A:SER339
|
3.8
|
20.7
|
0.5
|
CG2
|
A:THR209
|
3.8
|
12.9
|
1.0
|
CA
|
A:GLY216
|
3.9
|
11.7
|
1.0
|
CB
|
A:SER339
|
3.9
|
13.3
|
0.5
|
O
|
A:LEU340
|
3.9
|
14.7
|
1.0
|
C
|
A:THR209
|
4.0
|
10.7
|
1.0
|
O
|
A:HOH515
|
4.0
|
10.8
|
1.0
|
OG
|
A:SER339
|
4.1
|
22.8
|
0.5
|
N
|
A:GLY216
|
4.5
|
11.8
|
1.0
|
CD
|
A:LLP210
|
4.6
|
16.5
|
1.0
|
C
|
A:GLY216
|
4.7
|
11.1
|
1.0
|
CA
|
A:LLP210
|
4.7
|
11.4
|
1.0
|
N
|
A:LEU340
|
4.7
|
14.2
|
1.0
|
N
|
A:LLP210
|
4.8
|
10.4
|
1.0
|
CA
|
A:THR209
|
4.8
|
11.4
|
1.0
|
CB
|
A:THR209
|
4.9
|
11.2
|
1.0
|
C
|
A:LEU340
|
4.9
|
15.1
|
1.0
|
CA
|
A:SER339
|
5.0
|
17.9
|
0.5
|
CB
|
A:ASP342
|
5.0
|
14.5
|
1.0
|
|
Sodium binding site 2 out
of 5 in 4mkk
Go back to
Sodium Binding Sites List in 4mkk
Sodium binding site 2 out
of 5 in the Crystal Structure of C115A Mutant L-Methionine Gamma-Lyase From Citrobacter Freundii Modified By Allicine
Mono view
Stereo pair view
|
A full contact list of Sodium with other atoms in the Na binding
site number 2 of Crystal Structure of C115A Mutant L-Methionine Gamma-Lyase From Citrobacter Freundii Modified By Allicine within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Na404
b:24.5
occ:1.00
|
O
|
A:ALA84
|
2.7
|
11.6
|
1.0
|
N
|
A:MET246
|
2.9
|
11.3
|
1.0
|
CA
|
A:C1S245
|
3.3
|
15.4
|
0.5
|
CA
|
A:C1S245
|
3.3
|
12.7
|
0.5
|
O
|
A:HOH774
|
3.4
|
32.8
|
1.0
|
CB
|
A:C1S245
|
3.5
|
18.4
|
0.5
|
CB
|
A:C1S245
|
3.5
|
19.9
|
0.5
|
C
|
A:C1S245
|
3.6
|
14.1
|
0.5
|
C
|
A:ALA84
|
3.6
|
8.4
|
1.0
|
C
|
A:C1S245
|
3.6
|
11.4
|
0.5
|
O
|
A:HOH790
|
3.6
|
34.1
|
1.0
|
CB
|
A:MET246
|
3.9
|
10.5
|
1.0
|
CA
|
A:MET246
|
3.9
|
9.7
|
1.0
|
O
|
A:MET246
|
4.0
|
12.8
|
1.0
|
SG
|
A:C1S245
|
4.0
|
24.4
|
0.5
|
CD1
|
A:LEU238
|
4.1
|
17.2
|
1.0
|
O
|
A:HOH789
|
4.3
|
17.5
|
1.0
|
CB
|
A:ALA84
|
4.3
|
11.4
|
1.0
|
CG2
|
A:THR66
|
4.3
|
12.2
|
1.0
|
CA
|
A:ALA84
|
4.4
|
10.0
|
1.0
|
N
|
A:THR85
|
4.4
|
9.5
|
1.0
|
C
|
A:MET246
|
4.4
|
10.9
|
1.0
|
CA
|
A:THR85
|
4.5
|
10.7
|
1.0
|
OE2
|
A:GLU70
|
4.6
|
12.0
|
1.0
|
N
|
A:ALA84
|
4.6
|
9.2
|
1.0
|
N
|
A:C1S245
|
4.6
|
12.3
|
0.5
|
N
|
A:C1S245
|
4.7
|
13.5
|
0.5
|
O
|
A:GLY244
|
4.7
|
12.2
|
1.0
|
O
|
A:C1S245
|
4.8
|
15.2
|
0.5
|
O
|
A:C1S245
|
4.9
|
10.5
|
0.5
|
|
Sodium binding site 3 out
of 5 in 4mkk
Go back to
Sodium Binding Sites List in 4mkk
Sodium binding site 3 out
of 5 in the Crystal Structure of C115A Mutant L-Methionine Gamma-Lyase From Citrobacter Freundii Modified By Allicine
Mono view
Stereo pair view
|
A full contact list of Sodium with other atoms in the Na binding
site number 3 of Crystal Structure of C115A Mutant L-Methionine Gamma-Lyase From Citrobacter Freundii Modified By Allicine within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Na405
b:33.8
occ:1.00
|
O
|
A:ILE317
|
2.6
|
17.4
|
1.0
|
O
|
A:HOH582
|
2.7
|
36.5
|
1.0
|
O
|
A:HOH627
|
2.8
|
25.9
|
1.0
|
N
|
A:GLY320
|
2.9
|
22.8
|
1.0
|
CA
|
A:GLY320
|
3.3
|
22.2
|
1.0
|
N
|
A:GLY319
|
3.5
|
21.1
|
1.0
|
C
|
A:ILE317
|
3.8
|
15.6
|
1.0
|
CG
|
A:GLU316
|
3.9
|
13.3
|
0.6
|
C
|
A:ALA318
|
3.9
|
19.7
|
1.0
|
C
|
A:GLY319
|
4.0
|
23.7
|
1.0
|
O
|
A:HOH671
|
4.0
|
42.6
|
1.0
|
CA
|
A:GLY371
|
4.0
|
15.3
|
1.0
|
CD
|
A:GLU316
|
4.0
|
16.7
|
0.6
|
CA
|
A:ALA318
|
4.1
|
16.2
|
1.0
|
OE2
|
A:GLU316
|
4.2
|
16.6
|
0.6
|
CA
|
A:GLY319
|
4.3
|
22.3
|
1.0
|
N
|
A:GLY371
|
4.3
|
16.9
|
1.0
|
N
|
A:ALA318
|
4.4
|
15.4
|
1.0
|
O
|
A:HOH773
|
4.4
|
32.3
|
1.0
|
C
|
A:GLY320
|
4.5
|
20.6
|
1.0
|
OE1
|
A:GLU316
|
4.6
|
19.0
|
0.6
|
O
|
A:ALA318
|
4.8
|
21.1
|
1.0
|
O
|
A:GLY320
|
4.9
|
19.5
|
1.0
|
N
|
A:ILE317
|
4.9
|
14.8
|
1.0
|
CA
|
A:ILE317
|
5.0
|
15.2
|
1.0
|
|
Sodium binding site 4 out
of 5 in 4mkk
Go back to
Sodium Binding Sites List in 4mkk
Sodium binding site 4 out
of 5 in the Crystal Structure of C115A Mutant L-Methionine Gamma-Lyase From Citrobacter Freundii Modified By Allicine
Mono view
Stereo pair view
|
A full contact list of Sodium with other atoms in the Na binding
site number 4 of Crystal Structure of C115A Mutant L-Methionine Gamma-Lyase From Citrobacter Freundii Modified By Allicine within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Na407
b:36.6
occ:1.00
|
O
|
A:HOH598
|
2.8
|
22.9
|
1.0
|
O
|
A:HOH672
|
2.8
|
37.8
|
1.0
|
CL
|
A:CL406
|
2.8
|
43.9
|
1.0
|
O
|
A:HOH537
|
2.9
|
23.1
|
1.0
|
CD
|
A:PRO382
|
3.3
|
15.0
|
1.0
|
NH1
|
A:ARG267
|
3.7
|
19.4
|
1.0
|
CZ
|
A:ARG267
|
4.0
|
19.0
|
1.0
|
CG
|
A:PRO382
|
4.1
|
16.0
|
1.0
|
OD1
|
A:ASP381
|
4.2
|
16.3
|
1.0
|
CD
|
A:ARG267
|
4.3
|
16.3
|
1.0
|
NE
|
A:ARG267
|
4.3
|
18.4
|
1.0
|
OD1
|
A:ASN271
|
4.3
|
14.3
|
1.0
|
O3
|
A:PGE402
|
4.4
|
43.8
|
1.0
|
O
|
A:HOH661
|
4.5
|
37.3
|
1.0
|
C6
|
A:PGE402
|
4.5
|
40.8
|
1.0
|
CA
|
A:ASP381
|
4.5
|
10.9
|
1.0
|
N
|
A:PRO382
|
4.6
|
13.4
|
1.0
|
C5
|
A:PGE402
|
4.6
|
43.0
|
1.0
|
OE2
|
A:GLU270
|
4.6
|
21.6
|
1.0
|
O
|
A:HOH640
|
4.7
|
36.3
|
1.0
|
NH2
|
A:ARG267
|
4.7
|
21.3
|
1.0
|
O
|
A:GLU380
|
4.8
|
12.9
|
1.0
|
OE1
|
A:GLU383
|
4.9
|
15.7
|
0.5
|
CG
|
A:ASP381
|
5.0
|
14.7
|
1.0
|
|
Sodium binding site 5 out
of 5 in 4mkk
Go back to
Sodium Binding Sites List in 4mkk
Sodium binding site 5 out
of 5 in the Crystal Structure of C115A Mutant L-Methionine Gamma-Lyase From Citrobacter Freundii Modified By Allicine
Mono view
Stereo pair view
|
A full contact list of Sodium with other atoms in the Na binding
site number 5 of Crystal Structure of C115A Mutant L-Methionine Gamma-Lyase From Citrobacter Freundii Modified By Allicine within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Na408
b:41.9
occ:1.00
|
O
|
A:PRO64
|
2.7
|
12.2
|
1.0
|
O
|
A:HOH759
|
2.7
|
31.8
|
1.0
|
OD2
|
A:ASP67
|
3.3
|
20.8
|
1.0
|
C
|
A:PRO64
|
3.6
|
11.3
|
1.0
|
O
|
A:HOH754
|
3.7
|
76.3
|
1.0
|
N
|
A:ALA68
|
3.8
|
10.3
|
1.0
|
CA
|
A:PRO64
|
3.9
|
11.9
|
1.0
|
CB
|
A:ASP67
|
3.9
|
11.7
|
1.0
|
O
|
A:HOH809
|
3.9
|
45.4
|
1.0
|
CB
|
A:ALA68
|
4.0
|
9.4
|
1.0
|
CG
|
A:ASP67
|
4.1
|
16.5
|
1.0
|
OH
|
A:TYR58
|
4.1
|
61.0
|
0.9
|
CA
|
A:ALA68
|
4.2
|
10.6
|
1.0
|
CB
|
A:PRO64
|
4.3
|
14.8
|
1.0
|
C
|
A:ASP67
|
4.4
|
9.6
|
1.0
|
CA
|
A:ASP67
|
4.7
|
11.5
|
1.0
|
NE2
|
A:GLN19
|
4.7
|
27.7
|
0.6
|
N
|
A:THR65
|
4.8
|
10.5
|
1.0
|
O
|
A:GLY17
|
4.9
|
16.2
|
1.0
|
|
Reference:
E.A.Morozova,
S.V.Revtovich,
N.V.Anufrieva,
V.V.Kulikova,
A.D.Nikulin,
T.V.Demidkina.
Alliin Is A Suicide Substrate of Citrobacter Freundii Methionine [Gamma]-Lyase: Structural Bases of Inactivation of the Enzyme Acta Crystallogr.,Sect.D V. 70 3034 2014.
ISSN: ISSN 0907-4449
DOI: 10.1107/S1399004714020938
Page generated: Mon Oct 7 17:00:22 2024
|