Iodine in PDB 6doz: Crystal Structure of Bacillus Halodurans Ribonuclease H1 in Complex with An Rna/Dna Hybrid: Reaction in 1 Mm MG2+ and 75 Mm K+ For 40 S at 21 C
Enzymatic activity of Crystal Structure of Bacillus Halodurans Ribonuclease H1 in Complex with An Rna/Dna Hybrid: Reaction in 1 Mm MG2+ and 75 Mm K+ For 40 S at 21 C
All present enzymatic activity of Crystal Structure of Bacillus Halodurans Ribonuclease H1 in Complex with An Rna/Dna Hybrid: Reaction in 1 Mm MG2+ and 75 Mm K+ For 40 S at 21 C:
3.1.26.4;
Protein crystallography data
The structure of Crystal Structure of Bacillus Halodurans Ribonuclease H1 in Complex with An Rna/Dna Hybrid: Reaction in 1 Mm MG2+ and 75 Mm K+ For 40 S at 21 C, PDB code: 6doz
was solved by
N.L.Samara,
W.Yang,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
19.36 /
1.57
|
Space group
|
C 1 2 1
|
Cell size a, b, c (Å), α, β, γ (°)
|
81.576,
37.475,
62.495,
90.00,
96.67,
90.00
|
R / Rfree (%)
|
15.2 /
18.5
|
Other elements in 6doz:
The structure of Crystal Structure of Bacillus Halodurans Ribonuclease H1 in Complex with An Rna/Dna Hybrid: Reaction in 1 Mm MG2+ and 75 Mm K+ For 40 S at 21 C also contains other interesting chemical elements:
Iodine Binding Sites:
The binding sites of Iodine atom in the Crystal Structure of Bacillus Halodurans Ribonuclease H1 in Complex with An Rna/Dna Hybrid: Reaction in 1 Mm MG2+ and 75 Mm K+ For 40 S at 21 C
(pdb code 6doz). This binding sites where shown within
5.0 Angstroms radius around Iodine atom.
In total 3 binding sites of Iodine where determined in the
Crystal Structure of Bacillus Halodurans Ribonuclease H1 in Complex with An Rna/Dna Hybrid: Reaction in 1 Mm MG2+ and 75 Mm K+ For 40 S at 21 C, PDB code: 6doz:
Jump to Iodine binding site number:
1;
2;
3;
Iodine binding site 1 out
of 3 in 6doz
Go back to
Iodine Binding Sites List in 6doz
Iodine binding site 1 out
of 3 in the Crystal Structure of Bacillus Halodurans Ribonuclease H1 in Complex with An Rna/Dna Hybrid: Reaction in 1 Mm MG2+ and 75 Mm K+ For 40 S at 21 C
Mono view
Stereo pair view
|
A full contact list of Iodine with other atoms in the I binding
site number 1 of Crystal Structure of Bacillus Halodurans Ribonuclease H1 in Complex with An Rna/Dna Hybrid: Reaction in 1 Mm MG2+ and 75 Mm K+ For 40 S at 21 C within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:I204
b:32.0
occ:0.35
|
HH
|
A:TYR83
|
2.4
|
45.1
|
1.0
|
HD22
|
A:LEU161
|
3.0
|
42.1
|
1.0
|
HD13
|
A:LEU161
|
3.1
|
38.3
|
1.0
|
O
|
A:HOH349
|
3.2
|
45.6
|
1.0
|
OH
|
A:TYR83
|
3.3
|
37.6
|
1.0
|
HD22
|
A:LEU111
|
3.3
|
29.8
|
1.0
|
HD13
|
A:LEU111
|
3.3
|
32.1
|
1.0
|
HB3
|
A:LEU161
|
3.4
|
34.8
|
1.0
|
HD3
|
A:ARG97
|
3.4
|
42.8
|
1.0
|
HE2
|
A:TYR83
|
3.5
|
37.7
|
1.0
|
HB3
|
A:LEU111
|
3.5
|
25.7
|
1.0
|
O
|
A:HOH389
|
3.5
|
36.5
|
1.0
|
O
|
A:HOH361
|
3.8
|
27.6
|
1.0
|
CD2
|
A:LEU161
|
3.9
|
35.1
|
1.0
|
HH11
|
A:ARG97
|
4.0
|
53.2
|
1.0
|
CD1
|
A:LEU161
|
4.0
|
31.9
|
1.0
|
O
|
A:HOH358
|
4.1
|
41.2
|
1.0
|
CE2
|
A:TYR83
|
4.2
|
31.4
|
1.0
|
CZ
|
A:TYR83
|
4.2
|
30.2
|
1.0
|
CB
|
A:LEU161
|
4.2
|
29.0
|
1.0
|
CD1
|
A:LEU111
|
4.2
|
26.8
|
1.0
|
CD2
|
A:LEU111
|
4.2
|
24.9
|
1.0
|
CG
|
A:LEU161
|
4.2
|
31.1
|
1.0
|
HG2
|
A:ARG97
|
4.4
|
36.5
|
1.0
|
CD
|
A:ARG97
|
4.4
|
35.7
|
1.0
|
HD21
|
A:LEU161
|
4.4
|
42.1
|
1.0
|
CB
|
A:LEU111
|
4.4
|
21.4
|
1.0
|
HD11
|
A:LEU161
|
4.4
|
38.3
|
1.0
|
NH1
|
A:ARG97
|
4.5
|
44.4
|
1.0
|
CG
|
A:LEU111
|
4.5
|
23.6
|
1.0
|
HD23
|
A:LEU161
|
4.5
|
42.1
|
1.0
|
HD12
|
A:LEU161
|
4.7
|
38.3
|
1.0
|
HB2
|
A:HIS115
|
4.7
|
27.3
|
1.0
|
HD11
|
A:LEU111
|
4.7
|
32.1
|
1.0
|
HB2
|
A:LEU161
|
4.7
|
34.8
|
1.0
|
HD21
|
A:LEU111
|
4.7
|
29.8
|
1.0
|
HD11
|
A:ILE100
|
4.8
|
41.0
|
1.0
|
HH12
|
A:ARG97
|
4.8
|
53.2
|
1.0
|
HD23
|
A:LEU111
|
4.8
|
29.8
|
1.0
|
HD12
|
A:LEU111
|
4.9
|
32.1
|
1.0
|
O
|
A:HOH397
|
4.9
|
31.2
|
1.0
|
CG
|
A:ARG97
|
4.9
|
30.4
|
1.0
|
HB2
|
A:LEU111
|
4.9
|
25.7
|
1.0
|
HD2
|
A:ARG97
|
5.0
|
42.8
|
1.0
|
HB2
|
A:ARG97
|
5.0
|
34.3
|
1.0
|
NE
|
A:ARG97
|
5.0
|
36.5
|
1.0
|
|
Iodine binding site 2 out
of 3 in 6doz
Go back to
Iodine Binding Sites List in 6doz
Iodine binding site 2 out
of 3 in the Crystal Structure of Bacillus Halodurans Ribonuclease H1 in Complex with An Rna/Dna Hybrid: Reaction in 1 Mm MG2+ and 75 Mm K+ For 40 S at 21 C
Mono view
Stereo pair view
|
A full contact list of Iodine with other atoms in the I binding
site number 2 of Crystal Structure of Bacillus Halodurans Ribonuclease H1 in Complex with An Rna/Dna Hybrid: Reaction in 1 Mm MG2+ and 75 Mm K+ For 40 S at 21 C within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:I205
b:77.5
occ:0.40
|
O
|
A:HOH434
|
3.0
|
45.8
|
1.0
|
HD3
|
A:LYS180
|
3.1
|
34.3
|
1.0
|
HA
|
A:GLN134
|
3.1
|
30.1
|
1.0
|
O
|
A:HOH337
|
3.1
|
33.1
|
1.0
|
HB2
|
A:LYS180
|
3.1
|
34.4
|
1.0
|
HG3
|
A:GLN134
|
3.2
|
44.4
|
1.0
|
HD12
|
A:ILE137
|
3.4
|
36.0
|
1.0
|
HG21
|
A:ILE137
|
3.8
|
32.9
|
1.0
|
HG2
|
A:LYS180
|
3.8
|
39.0
|
1.0
|
HD13
|
A:ILE137
|
3.8
|
36.0
|
1.0
|
HB
|
A:ILE137
|
3.9
|
29.7
|
1.0
|
CD
|
A:LYS180
|
3.9
|
28.6
|
1.0
|
CB
|
A:LYS180
|
4.0
|
28.7
|
1.0
|
O
|
A:HOH327
|
4.0
|
41.3
|
1.0
|
O
|
A:HOH433
|
4.0
|
67.2
|
1.0
|
CA
|
A:GLN134
|
4.0
|
25.1
|
1.0
|
CG
|
A:GLN134
|
4.0
|
37.0
|
1.0
|
CD1
|
A:ILE137
|
4.1
|
30.0
|
1.0
|
CG
|
A:LYS180
|
4.1
|
32.5
|
1.0
|
HG2
|
A:GLN134
|
4.3
|
44.4
|
1.0
|
HE3
|
A:LYS180
|
4.4
|
32.9
|
1.0
|
HB3
|
A:LYS180
|
4.4
|
34.4
|
1.0
|
CB
|
A:GLN134
|
4.4
|
31.5
|
1.0
|
O
|
A:HOH429
|
4.5
|
48.1
|
1.0
|
CG2
|
A:ILE137
|
4.5
|
27.4
|
1.0
|
HB2
|
A:GLN134
|
4.5
|
37.8
|
1.0
|
CB
|
A:ILE137
|
4.5
|
24.8
|
1.0
|
HG22
|
A:ILE137
|
4.6
|
32.9
|
1.0
|
HD2
|
A:LYS180
|
4.6
|
34.3
|
1.0
|
O
|
A:GLN134
|
4.6
|
28.4
|
1.0
|
CE
|
A:LYS180
|
4.7
|
27.4
|
1.0
|
HE21
|
A:GLN134
|
4.8
|
46.6
|
1.0
|
HD11
|
A:ILE137
|
4.8
|
36.0
|
1.0
|
HE2
|
A:LYS180
|
4.8
|
32.9
|
1.0
|
C
|
A:GLN134
|
4.9
|
30.6
|
1.0
|
N
|
A:GLN134
|
4.9
|
24.5
|
1.0
|
CG1
|
A:ILE137
|
4.9
|
24.6
|
1.0
|
O
|
A:HOH415
|
4.9
|
40.8
|
1.0
|
HA
|
A:LYS180
|
5.0
|
29.8
|
1.0
|
|
Iodine binding site 3 out
of 3 in 6doz
Go back to
Iodine Binding Sites List in 6doz
Iodine binding site 3 out
of 3 in the Crystal Structure of Bacillus Halodurans Ribonuclease H1 in Complex with An Rna/Dna Hybrid: Reaction in 1 Mm MG2+ and 75 Mm K+ For 40 S at 21 C
Mono view
Stereo pair view
|
A full contact list of Iodine with other atoms in the I binding
site number 3 of Crystal Structure of Bacillus Halodurans Ribonuclease H1 in Complex with An Rna/Dna Hybrid: Reaction in 1 Mm MG2+ and 75 Mm K+ For 40 S at 21 C within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:I206
b:46.4
occ:0.25
|
O
|
A:HOH438
|
2.8
|
34.3
|
0.8
|
HG2
|
A:PRO177
|
2.9
|
30.4
|
1.0
|
HD11
|
A:LEU179
|
3.1
|
33.9
|
1.0
|
HG3
|
A:PRO128
|
3.2
|
37.3
|
1.0
|
HB2
|
A:PRO177
|
3.4
|
33.1
|
1.0
|
HB3
|
A:PRO128
|
3.4
|
29.4
|
1.0
|
CD1
|
A:ILE64
|
3.7
|
48.5
|
1.0
|
CG
|
A:PRO177
|
3.7
|
25.4
|
1.0
|
HD21
|
A:LEU179
|
3.7
|
37.7
|
1.0
|
HB3
|
A:PRO177
|
3.8
|
33.1
|
1.0
|
CB
|
A:PRO177
|
3.8
|
27.6
|
1.0
|
CG
|
A:PRO128
|
4.0
|
31.1
|
1.0
|
CD1
|
A:LEU179
|
4.1
|
28.2
|
1.0
|
CB
|
A:PRO128
|
4.1
|
24.5
|
1.0
|
HG3
|
A:PRO177
|
4.2
|
30.4
|
1.0
|
HD13
|
A:LEU179
|
4.4
|
33.9
|
1.0
|
HD3
|
A:PRO128
|
4.5
|
29.7
|
1.0
|
HB2
|
A:PRO128
|
4.5
|
29.4
|
1.0
|
CD2
|
A:LEU179
|
4.6
|
31.4
|
1.0
|
HD12
|
A:LEU179
|
4.6
|
33.9
|
1.0
|
HD2
|
A:PRO177
|
4.6
|
28.2
|
1.0
|
HG2
|
A:PRO128
|
4.7
|
37.3
|
1.0
|
CG
|
A:LEU179
|
4.7
|
26.7
|
1.0
|
HG
|
A:LEU179
|
4.7
|
32.0
|
1.0
|
CD
|
A:PRO177
|
4.8
|
23.5
|
1.0
|
CD
|
A:PRO128
|
4.8
|
24.8
|
1.0
|
HD22
|
A:LEU179
|
4.9
|
37.7
|
1.0
|
|
Reference:
N.L.Samara,
W.Yang.
Cation Trafficking Propels Rna Hydrolysis. Nat. Struct. Mol. Biol. V. 25 715 2018.
ISSN: ESSN 1545-9985
PubMed: 30076410
DOI: 10.1038/S41594-018-0099-4
Page generated: Sun Aug 11 22:59:16 2024
|