Calcium in PDB 5cwr: Crystal Structure of Human Dna Polymerase Lambda L431A Mutant in Complex with A One Nucleotide Dna Gap and Dctp
Enzymatic activity of Crystal Structure of Human Dna Polymerase Lambda L431A Mutant in Complex with A One Nucleotide Dna Gap and Dctp
All present enzymatic activity of Crystal Structure of Human Dna Polymerase Lambda L431A Mutant in Complex with A One Nucleotide Dna Gap and Dctp:
2.7.7.7;
Protein crystallography data
The structure of Crystal Structure of Human Dna Polymerase Lambda L431A Mutant in Complex with A One Nucleotide Dna Gap and Dctp, PDB code: 5cwr
was solved by
M.S.Liu,
M.D.Tsai,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
28.12 /
2.50
|
Space group
|
P 21 21 2
|
Cell size a, b, c (Å), α, β, γ (°)
|
93.003,
148.712,
86.414,
90.00,
90.00,
90.00
|
R / Rfree (%)
|
20.2 /
23.4
|
Calcium Binding Sites:
The binding sites of Calcium atom in the Crystal Structure of Human Dna Polymerase Lambda L431A Mutant in Complex with A One Nucleotide Dna Gap and Dctp
(pdb code 5cwr). This binding sites where shown within
5.0 Angstroms radius around Calcium atom.
In total 4 binding sites of Calcium where determined in the
Crystal Structure of Human Dna Polymerase Lambda L431A Mutant in Complex with A One Nucleotide Dna Gap and Dctp, PDB code: 5cwr:
Jump to Calcium binding site number:
1;
2;
3;
4;
Calcium binding site 1 out
of 4 in 5cwr
Go back to
Calcium Binding Sites List in 5cwr
Calcium binding site 1 out
of 4 in the Crystal Structure of Human Dna Polymerase Lambda L431A Mutant in Complex with A One Nucleotide Dna Gap and Dctp
Mono view
Stereo pair view
|
A full contact list of Calcium with other atoms in the Ca binding
site number 1 of Crystal Structure of Human Dna Polymerase Lambda L431A Mutant in Complex with A One Nucleotide Dna Gap and Dctp within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Ca602
b:34.3
occ:1.00
|
OD2
|
A:ASP427
|
2.5
|
30.5
|
1.0
|
OD1
|
A:ASP429
|
2.5
|
25.2
|
1.0
|
OD1
|
A:ASP490
|
2.5
|
31.3
|
1.0
|
O
|
A:HOH733
|
2.6
|
32.3
|
1.0
|
O1A
|
A:DCP601
|
2.7
|
16.7
|
1.0
|
O3'
|
P:DC6
|
2.9
|
27.9
|
1.0
|
OD1
|
A:ASP427
|
3.0
|
28.8
|
1.0
|
CG
|
A:ASP427
|
3.1
|
27.3
|
1.0
|
CG
|
A:ASP429
|
3.4
|
26.5
|
1.0
|
C3'
|
P:DC6
|
3.5
|
23.4
|
1.0
|
PA
|
A:DCP601
|
3.5
|
18.5
|
1.0
|
CG
|
A:ASP490
|
3.6
|
33.4
|
1.0
|
O2A
|
A:DCP601
|
3.6
|
25.1
|
1.0
|
OD2
|
A:ASP429
|
3.7
|
25.7
|
1.0
|
O5'
|
A:DCP601
|
3.7
|
24.2
|
1.0
|
C5'
|
A:DCP601
|
4.0
|
20.4
|
1.0
|
CA
|
A:CA603
|
4.0
|
25.6
|
1.0
|
C5'
|
P:DC6
|
4.2
|
25.0
|
1.0
|
CB
|
A:ASP490
|
4.2
|
25.0
|
1.0
|
C4'
|
P:DC6
|
4.3
|
24.5
|
1.0
|
O5'
|
P:DC6
|
4.5
|
27.1
|
1.0
|
CB
|
A:ASP427
|
4.6
|
27.3
|
1.0
|
OD2
|
A:ASP490
|
4.6
|
30.7
|
1.0
|
OP1
|
P:DC6
|
4.7
|
23.9
|
1.0
|
C2'
|
P:DC6
|
4.8
|
20.4
|
1.0
|
NH2
|
A:ARG488
|
4.8
|
23.2
|
1.0
|
CB
|
A:ASP429
|
4.8
|
24.2
|
1.0
|
O
|
A:HOH790
|
4.9
|
31.7
|
1.0
|
O3A
|
A:DCP601
|
5.0
|
26.6
|
1.0
|
|
Calcium binding site 2 out
of 4 in 5cwr
Go back to
Calcium Binding Sites List in 5cwr
Calcium binding site 2 out
of 4 in the Crystal Structure of Human Dna Polymerase Lambda L431A Mutant in Complex with A One Nucleotide Dna Gap and Dctp
Mono view
Stereo pair view
|
A full contact list of Calcium with other atoms in the Ca binding
site number 2 of Crystal Structure of Human Dna Polymerase Lambda L431A Mutant in Complex with A One Nucleotide Dna Gap and Dctp within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Ca603
b:25.6
occ:1.00
|
OD1
|
A:ASP427
|
2.2
|
28.8
|
1.0
|
OD2
|
A:ASP429
|
2.4
|
25.7
|
1.0
|
O1A
|
A:DCP601
|
2.4
|
16.7
|
1.0
|
O2B
|
A:DCP601
|
2.4
|
20.9
|
1.0
|
O2G
|
A:DCP601
|
2.5
|
20.9
|
1.0
|
O
|
A:HOH716
|
2.5
|
25.7
|
1.0
|
O
|
A:ASP427
|
2.8
|
33.1
|
1.0
|
CG
|
A:ASP427
|
3.4
|
27.3
|
1.0
|
CG
|
A:ASP429
|
3.4
|
26.5
|
1.0
|
PB
|
A:DCP601
|
3.6
|
21.2
|
1.0
|
PG
|
A:DCP601
|
3.6
|
21.5
|
1.0
|
C
|
A:ASP427
|
3.7
|
26.2
|
1.0
|
PA
|
A:DCP601
|
3.7
|
18.5
|
1.0
|
N
|
A:ASP427
|
3.7
|
27.1
|
1.0
|
O1G
|
A:DCP601
|
3.8
|
24.1
|
1.0
|
OD1
|
A:ASP429
|
3.9
|
25.2
|
1.0
|
O3B
|
A:DCP601
|
4.0
|
26.4
|
1.0
|
O3A
|
A:DCP601
|
4.0
|
26.6
|
1.0
|
CA
|
A:CA602
|
4.0
|
34.3
|
1.0
|
CA
|
A:ASP427
|
4.1
|
30.3
|
1.0
|
OG
|
A:SER417
|
4.1
|
23.6
|
1.0
|
OD2
|
A:ASP427
|
4.3
|
30.5
|
1.0
|
O
|
A:HOH714
|
4.3
|
27.3
|
1.0
|
CB
|
A:ASP427
|
4.3
|
27.3
|
1.0
|
N
|
A:SER417
|
4.4
|
25.7
|
1.0
|
C5'
|
A:DCP601
|
4.6
|
20.4
|
1.0
|
O
|
A:HOH790
|
4.6
|
31.7
|
1.0
|
CA
|
A:GLY416
|
4.6
|
22.8
|
1.0
|
CB
|
A:ASP429
|
4.7
|
24.2
|
1.0
|
N
|
A:GLY426
|
4.7
|
28.4
|
1.0
|
O5'
|
A:DCP601
|
4.7
|
24.2
|
1.0
|
N
|
A:VAL428
|
4.7
|
26.6
|
1.0
|
O2A
|
A:DCP601
|
4.7
|
25.1
|
1.0
|
C
|
A:GLY426
|
4.8
|
26.7
|
1.0
|
O1B
|
A:DCP601
|
4.8
|
23.2
|
1.0
|
N
|
A:ASP429
|
4.8
|
25.6
|
1.0
|
O3G
|
A:DCP601
|
4.9
|
30.6
|
1.0
|
O
|
A:HOH733
|
4.9
|
32.3
|
1.0
|
CB
|
A:SER417
|
5.0
|
20.4
|
1.0
|
CA
|
A:GLY426
|
5.0
|
30.5
|
1.0
|
|
Calcium binding site 3 out
of 4 in 5cwr
Go back to
Calcium Binding Sites List in 5cwr
Calcium binding site 3 out
of 4 in the Crystal Structure of Human Dna Polymerase Lambda L431A Mutant in Complex with A One Nucleotide Dna Gap and Dctp
Mono view
Stereo pair view
|
A full contact list of Calcium with other atoms in the Ca binding
site number 3 of Crystal Structure of Human Dna Polymerase Lambda L431A Mutant in Complex with A One Nucleotide Dna Gap and Dctp within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Ca602
b:35.2
occ:1.00
|
OD2
|
B:ASP427
|
2.5
|
30.1
|
1.0
|
OD2
|
B:ASP490
|
2.5
|
25.1
|
1.0
|
OD1
|
B:ASP429
|
2.5
|
27.5
|
1.0
|
O3'
|
E:DC6
|
2.7
|
23.8
|
1.0
|
O2A
|
B:DCP601
|
2.8
|
17.5
|
1.0
|
CG
|
B:ASP427
|
3.2
|
27.1
|
1.0
|
OD1
|
B:ASP427
|
3.2
|
29.3
|
1.0
|
CG
|
B:ASP429
|
3.4
|
24.5
|
1.0
|
O5'
|
B:DCP601
|
3.5
|
23.5
|
1.0
|
C3'
|
E:DC6
|
3.6
|
21.8
|
1.0
|
OD2
|
B:ASP429
|
3.6
|
26.0
|
1.0
|
PA
|
B:DCP601
|
3.6
|
24.8
|
1.0
|
CG
|
B:ASP490
|
3.6
|
30.0
|
1.0
|
C5'
|
B:DCP601
|
3.8
|
17.1
|
1.0
|
CA
|
B:CA603
|
4.0
|
28.7
|
1.0
|
O1A
|
B:DCP601
|
4.0
|
25.0
|
1.0
|
CB
|
B:ASP490
|
4.3
|
23.9
|
1.0
|
C5'
|
E:DC6
|
4.3
|
21.7
|
1.0
|
C4'
|
E:DC6
|
4.3
|
23.4
|
1.0
|
O
|
B:HOH778
|
4.5
|
26.5
|
1.0
|
OD1
|
B:ASP490
|
4.6
|
31.4
|
1.0
|
O5'
|
E:DC6
|
4.6
|
23.1
|
1.0
|
CB
|
B:ASP427
|
4.7
|
28.1
|
1.0
|
OP1
|
E:DC6
|
4.8
|
22.0
|
1.0
|
CB
|
B:ASP429
|
4.8
|
22.7
|
1.0
|
NH2
|
B:ARG488
|
4.8
|
22.8
|
1.0
|
C2'
|
E:DC6
|
4.9
|
22.2
|
1.0
|
|
Calcium binding site 4 out
of 4 in 5cwr
Go back to
Calcium Binding Sites List in 5cwr
Calcium binding site 4 out
of 4 in the Crystal Structure of Human Dna Polymerase Lambda L431A Mutant in Complex with A One Nucleotide Dna Gap and Dctp
Mono view
Stereo pair view
|
A full contact list of Calcium with other atoms in the Ca binding
site number 4 of Crystal Structure of Human Dna Polymerase Lambda L431A Mutant in Complex with A One Nucleotide Dna Gap and Dctp within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Ca603
b:28.7
occ:1.00
|
OD1
|
B:ASP427
|
2.2
|
29.3
|
1.0
|
OD2
|
B:ASP429
|
2.3
|
26.0
|
1.0
|
O2A
|
B:DCP601
|
2.4
|
17.5
|
1.0
|
O1B
|
B:DCP601
|
2.4
|
17.7
|
1.0
|
O2G
|
B:DCP601
|
2.5
|
22.3
|
1.0
|
O
|
B:HOH717
|
2.6
|
25.5
|
1.0
|
O
|
B:ASP427
|
3.0
|
27.4
|
1.0
|
CG
|
B:ASP429
|
3.4
|
24.5
|
1.0
|
CG
|
B:ASP427
|
3.4
|
27.1
|
1.0
|
PB
|
B:DCP601
|
3.6
|
19.4
|
1.0
|
PG
|
B:DCP601
|
3.6
|
24.5
|
1.0
|
PA
|
B:DCP601
|
3.7
|
24.8
|
1.0
|
C
|
B:ASP427
|
3.8
|
24.2
|
1.0
|
OD1
|
B:ASP429
|
3.8
|
27.5
|
1.0
|
CA
|
B:CA602
|
4.0
|
35.2
|
1.0
|
O3G
|
B:DCP601
|
4.0
|
24.6
|
1.0
|
N
|
B:ASP427
|
4.0
|
26.3
|
1.0
|
O3B
|
B:DCP601
|
4.0
|
25.0
|
1.0
|
O3A
|
B:DCP601
|
4.1
|
26.5
|
1.0
|
O
|
B:HOH727
|
4.1
|
22.7
|
1.0
|
OD2
|
B:ASP427
|
4.1
|
30.1
|
1.0
|
OG
|
B:SER417
|
4.2
|
23.5
|
1.0
|
CA
|
B:ASP427
|
4.3
|
27.4
|
1.0
|
N
|
B:SER417
|
4.3
|
24.8
|
1.0
|
O
|
B:HOH778
|
4.4
|
26.5
|
1.0
|
C5'
|
B:DCP601
|
4.4
|
17.1
|
1.0
|
CB
|
B:ASP427
|
4.5
|
28.1
|
1.0
|
CA
|
B:GLY416
|
4.5
|
19.6
|
1.0
|
O5'
|
B:DCP601
|
4.6
|
23.5
|
1.0
|
CB
|
B:ASP429
|
4.6
|
22.7
|
1.0
|
N
|
B:VAL428
|
4.7
|
26.9
|
1.0
|
O1A
|
B:DCP601
|
4.7
|
25.0
|
1.0
|
O2B
|
B:DCP601
|
4.8
|
19.9
|
1.0
|
N
|
B:ASP429
|
4.9
|
23.1
|
1.0
|
O1G
|
B:DCP601
|
4.9
|
29.2
|
1.0
|
N
|
B:GLY426
|
4.9
|
25.6
|
1.0
|
C
|
B:GLY416
|
5.0
|
23.2
|
1.0
|
C
|
B:VAL428
|
5.0
|
27.2
|
1.0
|
|
Reference:
M.S.Liu,
H.Y.Tsai,
X.X.Liu,
M.C.Ho,
W.J.Wu,
M.D.Tsai.
Structural Mechanism For the Fidelity Modulation of Dna Polymerase Lambda J.Am.Chem.Soc. V. 138 2389 2016.
ISSN: ESSN 1520-5126
PubMed: 26836966
DOI: 10.1021/JACS.5B13368
Page generated: Sun Jul 14 17:22:49 2024
|