Chlorine in PDB 4kgn: Crystal Structure of A Trna (Cytidine(34)-2'-O)-Methyltransferase Bound to S-Adenosyl Homocysteine
Enzymatic activity of Crystal Structure of A Trna (Cytidine(34)-2'-O)-Methyltransferase Bound to S-Adenosyl Homocysteine
All present enzymatic activity of Crystal Structure of A Trna (Cytidine(34)-2'-O)-Methyltransferase Bound to S-Adenosyl Homocysteine:
2.1.1.207;
Protein crystallography data
The structure of Crystal Structure of A Trna (Cytidine(34)-2'-O)-Methyltransferase Bound to S-Adenosyl Homocysteine, PDB code: 4kgn
was solved by
Seattle Structural Genomics Center For Infectious Disease (Ssgcid),
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
44.17 /
2.15
|
Space group
|
P 1 21 1
|
Cell size a, b, c (Å), α, β, γ (°)
|
52.600,
149.710,
80.300,
90.00,
90.49,
90.00
|
R / Rfree (%)
|
16.9 /
19.3
|
Chlorine Binding Sites:
The binding sites of Chlorine atom in the Crystal Structure of A Trna (Cytidine(34)-2'-O)-Methyltransferase Bound to S-Adenosyl Homocysteine
(pdb code 4kgn). This binding sites where shown within
5.0 Angstroms radius around Chlorine atom.
In total 6 binding sites of Chlorine where determined in the
Crystal Structure of A Trna (Cytidine(34)-2'-O)-Methyltransferase Bound to S-Adenosyl Homocysteine, PDB code: 4kgn:
Jump to Chlorine binding site number:
1;
2;
3;
4;
5;
6;
Chlorine binding site 1 out
of 6 in 4kgn
Go back to
Chlorine Binding Sites List in 4kgn
Chlorine binding site 1 out
of 6 in the Crystal Structure of A Trna (Cytidine(34)-2'-O)-Methyltransferase Bound to S-Adenosyl Homocysteine
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 A Trna (Cytidine(34)-2'-O)-Methyltransferase Bound to S-Adenosyl Homocysteine within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cl202
b:21.4
occ:1.00
|
O
|
B:HOH315
|
2.8
|
29.4
|
1.0
|
N
|
A:ASN134
|
3.3
|
17.8
|
1.0
|
ND2
|
A:ASN137
|
3.3
|
16.7
|
1.0
|
ND2
|
B:ASN24
|
3.4
|
18.2
|
1.0
|
CA
|
A:LEU133
|
3.6
|
18.0
|
1.0
|
CA
|
B:LEU21
|
3.6
|
21.4
|
1.0
|
CD1
|
B:LEU21
|
3.7
|
22.4
|
1.0
|
CB
|
B:LEU21
|
3.8
|
21.9
|
1.0
|
CD2
|
A:LEU133
|
3.9
|
17.2
|
1.0
|
CB
|
A:LEU133
|
3.9
|
17.6
|
1.0
|
N
|
B:LEU21
|
3.9
|
21.4
|
1.0
|
C
|
A:LEU133
|
3.9
|
18.3
|
1.0
|
CB
|
A:ASN134
|
4.1
|
17.9
|
1.0
|
CA
|
A:ASN134
|
4.3
|
17.8
|
1.0
|
CG
|
A:ASN137
|
4.3
|
16.9
|
1.0
|
CB
|
A:ASN137
|
4.3
|
16.5
|
1.0
|
CG
|
B:LEU21
|
4.4
|
23.4
|
1.0
|
C
|
B:ARG20
|
4.5
|
20.9
|
1.0
|
CG
|
B:ARG20
|
4.5
|
31.4
|
1.0
|
CG
|
B:ASN24
|
4.5
|
18.4
|
1.0
|
CG
|
A:LEU133
|
4.6
|
16.9
|
1.0
|
O
|
B:ARG20
|
4.6
|
19.7
|
1.0
|
O
|
B:ASN17
|
4.8
|
19.6
|
1.0
|
O
|
A:SER132
|
4.8
|
18.0
|
1.0
|
CB
|
B:ASN24
|
4.8
|
18.8
|
1.0
|
N
|
A:LEU133
|
4.9
|
18.3
|
1.0
|
C
|
B:LEU21
|
5.0
|
19.7
|
1.0
|
|
Chlorine binding site 2 out
of 6 in 4kgn
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Chlorine Binding Sites List in 4kgn
Chlorine binding site 2 out
of 6 in the Crystal Structure of A Trna (Cytidine(34)-2'-O)-Methyltransferase Bound to S-Adenosyl Homocysteine
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 A Trna (Cytidine(34)-2'-O)-Methyltransferase Bound to S-Adenosyl Homocysteine within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Cl201
b:35.7
occ:1.00
|
N
|
B:GLU10
|
3.2
|
35.5
|
1.0
|
N
|
B:GLU104
|
3.4
|
41.2
|
1.0
|
N
|
B:ILE11
|
3.4
|
34.0
|
1.0
|
O
|
B:HOH321
|
3.5
|
32.1
|
1.0
|
ND2
|
B:ASN14
|
3.8
|
32.1
|
1.0
|
CB
|
B:GLU104
|
3.8
|
44.6
|
1.0
|
CD2
|
B:LEU135
|
3.9
|
30.3
|
1.0
|
CA
|
B:GLU10
|
4.0
|
37.7
|
1.0
|
CB
|
B:GLU10
|
4.0
|
38.3
|
1.0
|
C
|
B:PRO9
|
4.1
|
34.0
|
1.0
|
CA
|
B:PRO9
|
4.1
|
32.6
|
1.0
|
CA
|
B:ALA103
|
4.1
|
38.5
|
1.0
|
CB
|
B:ILE11
|
4.1
|
34.2
|
1.0
|
C
|
B:GLU10
|
4.2
|
37.2
|
1.0
|
CA
|
B:GLU104
|
4.2
|
44.8
|
1.0
|
C
|
B:ALA103
|
4.2
|
39.8
|
1.0
|
CA
|
B:ILE11
|
4.3
|
33.0
|
1.0
|
CD1
|
B:ILE11
|
4.3
|
35.9
|
1.0
|
CG1
|
B:ILE11
|
4.3
|
36.0
|
1.0
|
CB
|
B:ALA103
|
4.5
|
39.5
|
1.0
|
CB
|
B:PRO9
|
4.5
|
30.9
|
1.0
|
O
|
B:ILE11
|
4.6
|
27.4
|
1.0
|
CB
|
B:ASN14
|
4.6
|
29.3
|
1.0
|
CG
|
B:ASN14
|
4.7
|
32.0
|
1.0
|
C
|
B:ILE11
|
4.9
|
30.6
|
1.0
|
O
|
B:HOH322
|
5.0
|
40.7
|
1.0
|
|
Chlorine binding site 3 out
of 6 in 4kgn
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Chlorine Binding Sites List in 4kgn
Chlorine binding site 3 out
of 6 in the Crystal Structure of A Trna (Cytidine(34)-2'-O)-Methyltransferase Bound to S-Adenosyl Homocysteine
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 A Trna (Cytidine(34)-2'-O)-Methyltransferase Bound to S-Adenosyl Homocysteine within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:Cl202
b:19.3
occ:1.00
|
O
|
D:HOH205
|
2.9
|
28.6
|
1.0
|
ND2
|
C:ASN137
|
3.1
|
17.6
|
1.0
|
N
|
C:ASN134
|
3.2
|
18.7
|
1.0
|
ND2
|
D:ASN24
|
3.4
|
21.6
|
1.0
|
CA
|
C:LEU133
|
3.6
|
18.6
|
1.0
|
CD1
|
D:LEU21
|
3.6
|
25.8
|
1.0
|
CA
|
D:LEU21
|
3.7
|
23.4
|
1.0
|
CB
|
D:LEU21
|
3.8
|
23.7
|
1.0
|
CD2
|
C:LEU133
|
3.9
|
18.2
|
1.0
|
CB
|
C:LEU133
|
3.9
|
17.7
|
1.0
|
CB
|
C:ASN134
|
3.9
|
18.7
|
1.0
|
C
|
C:LEU133
|
3.9
|
18.9
|
1.0
|
N
|
D:LEU21
|
4.0
|
23.5
|
1.0
|
CG
|
C:ASN137
|
4.1
|
17.8
|
1.0
|
CB
|
C:ASN137
|
4.1
|
17.6
|
1.0
|
CA
|
C:ASN134
|
4.2
|
18.4
|
1.0
|
CG
|
D:ARG20
|
4.3
|
35.6
|
1.0
|
CG
|
D:LEU21
|
4.3
|
25.3
|
1.0
|
C
|
D:ARG20
|
4.4
|
25.2
|
1.0
|
CG
|
C:LEU133
|
4.5
|
17.9
|
1.0
|
CG
|
D:ASN24
|
4.6
|
21.7
|
1.0
|
O
|
D:ARG20
|
4.6
|
24.0
|
1.0
|
CD
|
D:ARG20
|
4.6
|
41.8
|
1.0
|
O
|
D:ASN17
|
4.8
|
26.7
|
1.0
|
O
|
C:SER132
|
4.8
|
21.9
|
1.0
|
CB
|
D:ARG20
|
4.8
|
30.4
|
1.0
|
N
|
C:LEU133
|
4.9
|
19.9
|
1.0
|
CB
|
D:ASN24
|
4.9
|
21.4
|
1.0
|
O
|
C:ASN134
|
5.0
|
17.5
|
1.0
|
NE
|
D:ARG20
|
5.0
|
48.9
|
1.0
|
|
Chlorine binding site 4 out
of 6 in 4kgn
Go back to
Chlorine Binding Sites List in 4kgn
Chlorine binding site 4 out
of 6 in the Crystal Structure of A Trna (Cytidine(34)-2'-O)-Methyltransferase Bound to S-Adenosyl Homocysteine
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 A Trna (Cytidine(34)-2'-O)-Methyltransferase Bound to S-Adenosyl Homocysteine within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
E:Cl202
b:23.0
occ:1.00
|
O
|
F:HOH309
|
3.1
|
25.0
|
1.0
|
N
|
E:ASN134
|
3.2
|
17.6
|
1.0
|
ND2
|
F:ASN24
|
3.3
|
22.5
|
1.0
|
ND2
|
E:ASN137
|
3.4
|
18.5
|
1.0
|
CA
|
E:LEU133
|
3.6
|
18.2
|
1.0
|
CA
|
F:LEU21
|
3.6
|
22.4
|
1.0
|
CD2
|
E:LEU133
|
3.8
|
18.7
|
1.0
|
CB
|
F:LEU21
|
3.8
|
23.4
|
1.0
|
CD1
|
F:LEU21
|
3.9
|
24.3
|
1.0
|
C
|
E:LEU133
|
3.9
|
18.0
|
1.0
|
CB
|
E:LEU133
|
3.9
|
17.9
|
1.0
|
N
|
F:LEU21
|
4.0
|
21.8
|
1.0
|
CB
|
E:ASN134
|
4.1
|
18.6
|
1.0
|
CA
|
E:ASN134
|
4.2
|
17.9
|
1.0
|
CB
|
E:ASN137
|
4.3
|
17.9
|
1.0
|
CG
|
E:ASN137
|
4.4
|
18.4
|
1.0
|
C
|
F:ARG20
|
4.4
|
21.6
|
1.0
|
CG
|
E:LEU133
|
4.4
|
18.8
|
1.0
|
CG
|
F:ASN24
|
4.5
|
22.6
|
1.0
|
CG
|
F:LEU21
|
4.5
|
24.4
|
1.0
|
O
|
F:ARG20
|
4.6
|
20.9
|
1.0
|
CB
|
F:ASN24
|
4.7
|
22.1
|
1.0
|
CB
|
F:ARG20
|
4.8
|
23.2
|
1.0
|
O
|
E:SER132
|
4.8
|
21.3
|
1.0
|
N
|
E:LEU133
|
4.8
|
19.3
|
1.0
|
O
|
F:ASN17
|
4.9
|
22.3
|
1.0
|
C
|
F:LEU21
|
4.9
|
22.1
|
1.0
|
|
Chlorine binding site 5 out
of 6 in 4kgn
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Chlorine Binding Sites List in 4kgn
Chlorine binding site 5 out
of 6 in the Crystal Structure of A Trna (Cytidine(34)-2'-O)-Methyltransferase Bound to S-Adenosyl Homocysteine
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 A Trna (Cytidine(34)-2'-O)-Methyltransferase Bound to S-Adenosyl Homocysteine within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
F:Cl201
b:40.1
occ:1.00
|
O
|
F:HOH303
|
3.0
|
36.9
|
1.0
|
N
|
F:GLU10
|
3.3
|
35.5
|
1.0
|
N
|
F:ILE11
|
3.3
|
40.8
|
1.0
|
N
|
F:GLU104
|
3.7
|
40.2
|
1.0
|
ND2
|
F:ASN14
|
3.7
|
40.3
|
1.0
|
CB
|
F:ILE11
|
3.9
|
44.3
|
1.0
|
CD2
|
F:LEU135
|
4.0
|
32.5
|
1.0
|
CG1
|
F:ILE11
|
4.0
|
46.6
|
1.0
|
CA
|
F:GLU10
|
4.0
|
38.3
|
1.0
|
CB
|
F:GLU104
|
4.1
|
44.7
|
1.0
|
CD1
|
F:ILE11
|
4.1
|
46.0
|
1.0
|
CB
|
F:GLU10
|
4.1
|
38.9
|
1.0
|
CA
|
F:ILE11
|
4.2
|
42.0
|
1.0
|
C
|
F:GLU10
|
4.2
|
40.7
|
1.0
|
C
|
F:PRO9
|
4.2
|
33.5
|
1.0
|
CA
|
F:PRO9
|
4.3
|
31.2
|
1.0
|
CA
|
F:ALA103
|
4.3
|
35.3
|
1.0
|
O
|
F:ILE11
|
4.3
|
41.0
|
1.0
|
CB
|
F:ASN14
|
4.4
|
36.5
|
1.0
|
C
|
F:ALA103
|
4.5
|
36.8
|
1.0
|
CA
|
F:GLU104
|
4.5
|
43.6
|
1.0
|
CB
|
F:PRO9
|
4.5
|
30.6
|
1.0
|
CB
|
F:ALA103
|
4.6
|
36.9
|
1.0
|
CG
|
F:ASN14
|
4.6
|
39.4
|
1.0
|
C
|
F:ILE11
|
4.8
|
40.3
|
1.0
|
|
Chlorine binding site 6 out
of 6 in 4kgn
Go back to
Chlorine Binding Sites List in 4kgn
Chlorine binding site 6 out
of 6 in the Crystal Structure of A Trna (Cytidine(34)-2'-O)-Methyltransferase Bound to S-Adenosyl Homocysteine
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 A Trna (Cytidine(34)-2'-O)-Methyltransferase Bound to S-Adenosyl Homocysteine within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
G:Cl202
b:21.4
occ:1.00
|
ND2
|
G:ASN137
|
3.1
|
18.0
|
1.0
|
O
|
H:HOH214
|
3.1
|
26.5
|
1.0
|
N
|
G:ASN134
|
3.3
|
18.6
|
1.0
|
ND2
|
H:ASN24
|
3.5
|
22.8
|
1.0
|
CA
|
G:LEU133
|
3.6
|
17.6
|
1.0
|
CA
|
H:LEU21
|
3.6
|
20.4
|
1.0
|
CB
|
H:LEU21
|
3.8
|
21.3
|
1.0
|
CD2
|
G:LEU133
|
3.8
|
17.7
|
1.0
|
CD1
|
H:LEU21
|
3.9
|
21.7
|
1.0
|
CB
|
G:LEU133
|
3.9
|
17.1
|
1.0
|
C
|
G:LEU133
|
3.9
|
17.8
|
1.0
|
N
|
H:LEU21
|
4.0
|
21.2
|
1.0
|
CB
|
G:ASN134
|
4.1
|
18.1
|
1.0
|
CG
|
G:ASN137
|
4.1
|
17.6
|
1.0
|
CB
|
G:ASN137
|
4.2
|
17.7
|
1.0
|
CA
|
G:ASN134
|
4.3
|
18.8
|
1.0
|
CG
|
H:ARG20
|
4.3
|
28.8
|
1.0
|
CG
|
H:LEU21
|
4.4
|
22.4
|
1.0
|
C
|
H:ARG20
|
4.5
|
22.2
|
1.0
|
CG
|
G:LEU133
|
4.5
|
17.0
|
1.0
|
CG
|
H:ASN24
|
4.6
|
21.2
|
1.0
|
O
|
H:ARG20
|
4.6
|
21.6
|
1.0
|
O
|
H:ASN17
|
4.7
|
23.9
|
1.0
|
O
|
G:SER132
|
4.8
|
19.3
|
1.0
|
CB
|
H:ASN24
|
4.8
|
20.6
|
1.0
|
N
|
G:LEU133
|
4.8
|
18.6
|
1.0
|
C
|
H:LEU21
|
4.9
|
19.9
|
1.0
|
CB
|
H:ARG20
|
5.0
|
26.0
|
1.0
|
|
Reference:
T.E.Edwards,
J.W.Fairman,
Seattle Structural Genomics Center For Infectious Disease(Ssgcid).
Crystal Structure of A Trmh Family Trna Methyltransferase Bound to S-Adenosyl Homocysteine To Be Published.
Page generated: Sun Jul 21 18:09:20 2024
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