Calcium in PDB 1wmf: Crystal Structure of Alkaline Serine Protease Kp-43 From Bacillus Sp. Ksm-KP43 (Oxidized Form, 1.73 Angstrom)
Protein crystallography data
The structure of Crystal Structure of Alkaline Serine Protease Kp-43 From Bacillus Sp. Ksm-KP43 (Oxidized Form, 1.73 Angstrom), PDB code: 1wmf
was solved by
T.Nonaka,
M.Fujihashi,
A.Kita,
K.Saeki,
S.Ito,
K.Horikoshi,
K.Miki,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
20.00 /
1.73
|
Space group
|
C 2 2 21
|
Cell size a, b, c (Å), α, β, γ (°)
|
42.917,
109.153,
167.164,
90.00,
90.00,
90.00
|
R / Rfree (%)
|
14.2 /
21.2
|
Calcium Binding Sites:
The binding sites of Calcium atom in the Crystal Structure of Alkaline Serine Protease Kp-43 From Bacillus Sp. Ksm-KP43 (Oxidized Form, 1.73 Angstrom)
(pdb code 1wmf). This binding sites where shown within
5.0 Angstroms radius around Calcium atom.
In total 3 binding sites of Calcium where determined in the
Crystal Structure of Alkaline Serine Protease Kp-43 From Bacillus Sp. Ksm-KP43 (Oxidized Form, 1.73 Angstrom), PDB code: 1wmf:
Jump to Calcium binding site number:
1;
2;
3;
Calcium binding site 1 out
of 3 in 1wmf
Go back to
Calcium Binding Sites List in 1wmf
Calcium binding site 1 out
of 3 in the Crystal Structure of Alkaline Serine Protease Kp-43 From Bacillus Sp. Ksm-KP43 (Oxidized Form, 1.73 Angstrom)
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 Alkaline Serine Protease Kp-43 From Bacillus Sp. Ksm-KP43 (Oxidized Form, 1.73 Angstrom) within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Ca1001
b:15.4
occ:1.00
|
O
|
A:SER194
|
2.2
|
16.4
|
1.0
|
O
|
A:HOH3002
|
2.4
|
19.1
|
1.0
|
OD1
|
A:ASP197
|
2.4
|
15.9
|
1.0
|
OE2
|
A:GLU186
|
2.4
|
14.8
|
1.0
|
O
|
A:HOH3001
|
2.4
|
16.9
|
1.0
|
OE1
|
A:GLU186
|
2.4
|
14.5
|
1.0
|
ND1
|
A:HIS201
|
2.6
|
19.2
|
1.0
|
CD
|
A:GLU186
|
2.8
|
13.6
|
1.0
|
CE1
|
A:HIS201
|
3.3
|
20.7
|
1.0
|
C
|
A:SER194
|
3.4
|
16.3
|
1.0
|
CG
|
A:ASP197
|
3.5
|
15.2
|
1.0
|
CG
|
A:HIS201
|
3.8
|
18.1
|
1.0
|
OD2
|
A:ASP197
|
3.9
|
16.6
|
1.0
|
CA
|
A:SER194
|
4.1
|
17.4
|
1.0
|
CB
|
A:HIS201
|
4.2
|
15.7
|
1.0
|
CG
|
A:GLU186
|
4.3
|
13.2
|
1.0
|
N
|
A:ASP197
|
4.4
|
13.9
|
1.0
|
CB
|
A:SER194
|
4.4
|
19.3
|
1.0
|
O
|
A:HOH3130
|
4.5
|
35.4
|
1.0
|
N
|
A:TYR195
|
4.5
|
15.8
|
1.0
|
N
|
A:ASN198
|
4.5
|
13.2
|
1.0
|
O
|
A:HOH3054
|
4.5
|
21.4
|
1.0
|
NE2
|
A:HIS201
|
4.5
|
22.2
|
1.0
|
CA
|
A:TYR195
|
4.6
|
16.4
|
1.0
|
O
|
A:HOH3196
|
4.6
|
37.0
|
1.0
|
CB
|
A:ASP197
|
4.7
|
14.9
|
1.0
|
C
|
A:TYR195
|
4.7
|
14.9
|
1.0
|
CB
|
A:ASN198
|
4.7
|
12.2
|
1.0
|
CD2
|
A:HIS201
|
4.8
|
20.9
|
1.0
|
N
|
A:ALA196
|
4.8
|
13.5
|
1.0
|
CA
|
A:ASP197
|
4.9
|
13.3
|
1.0
|
C
|
A:ASP197
|
4.9
|
12.8
|
1.0
|
|
Calcium binding site 2 out
of 3 in 1wmf
Go back to
Calcium Binding Sites List in 1wmf
Calcium binding site 2 out
of 3 in the Crystal Structure of Alkaline Serine Protease Kp-43 From Bacillus Sp. Ksm-KP43 (Oxidized Form, 1.73 Angstrom)
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 Alkaline Serine Protease Kp-43 From Bacillus Sp. Ksm-KP43 (Oxidized Form, 1.73 Angstrom) within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Ca1002
b:22.6
occ:1.00
|
OD1
|
A:ASN392
|
2.3
|
25.2
|
1.0
|
OD1
|
A:ASP391
|
2.3
|
22.3
|
1.0
|
O
|
A:THR386
|
2.4
|
21.8
|
1.0
|
OD1
|
A:ASP384
|
2.4
|
20.9
|
1.0
|
O
|
A:HOH3003
|
2.4
|
17.5
|
1.0
|
O
|
A:PRO388
|
2.4
|
21.1
|
1.0
|
OD2
|
A:ASP384
|
2.5
|
19.2
|
1.0
|
OG1
|
A:THR386
|
2.5
|
21.9
|
1.0
|
CG
|
A:ASP384
|
2.8
|
19.4
|
1.0
|
C
|
A:THR386
|
3.4
|
22.4
|
1.0
|
CG
|
A:ASN392
|
3.4
|
23.7
|
1.0
|
CG
|
A:ASP391
|
3.4
|
22.3
|
1.0
|
C
|
A:PRO388
|
3.6
|
22.4
|
1.0
|
CB
|
A:THR386
|
3.7
|
22.0
|
1.0
|
OD2
|
A:ASP391
|
3.9
|
19.1
|
1.0
|
CA
|
A:THR386
|
3.9
|
22.3
|
1.0
|
O
|
A:HOH3240
|
4.0
|
36.2
|
1.0
|
N
|
A:THR386
|
4.1
|
22.8
|
1.0
|
CA
|
A:TYR389
|
4.1
|
23.6
|
1.0
|
CB
|
A:ASN392
|
4.2
|
21.4
|
1.0
|
O
|
A:HOH3160
|
4.2
|
43.6
|
1.0
|
N
|
A:ASN392
|
4.3
|
22.2
|
1.0
|
CB
|
A:ASP384
|
4.3
|
18.1
|
1.0
|
N
|
A:TYR389
|
4.3
|
23.7
|
1.0
|
N
|
A:ASP391
|
4.3
|
22.8
|
1.0
|
N
|
A:PRO388
|
4.3
|
26.6
|
1.0
|
C
|
A:SER387
|
4.3
|
26.6
|
1.0
|
ND2
|
A:ASN392
|
4.4
|
25.0
|
1.0
|
N
|
A:SER387
|
4.5
|
24.2
|
1.0
|
O
|
A:HOH3176
|
4.5
|
29.0
|
1.0
|
C
|
A:TYR389
|
4.5
|
20.6
|
1.0
|
CA
|
A:PRO388
|
4.6
|
24.9
|
1.0
|
O
|
A:SER387
|
4.6
|
29.2
|
1.0
|
N
|
A:ASN390
|
4.7
|
20.8
|
1.0
|
CB
|
A:ASP391
|
4.7
|
21.9
|
1.0
|
CA
|
A:SER387
|
4.7
|
25.3
|
1.0
|
C
|
A:ASP391
|
4.8
|
22.1
|
1.0
|
CD
|
A:PRO388
|
4.8
|
27.0
|
1.0
|
CA
|
A:ASP391
|
4.8
|
23.4
|
1.0
|
CA
|
A:ASN392
|
4.9
|
21.1
|
1.0
|
CG2
|
A:THR386
|
4.9
|
23.4
|
1.0
|
|
Calcium binding site 3 out
of 3 in 1wmf
Go back to
Calcium Binding Sites List in 1wmf
Calcium binding site 3 out
of 3 in the Crystal Structure of Alkaline Serine Protease Kp-43 From Bacillus Sp. Ksm-KP43 (Oxidized Form, 1.73 Angstrom)
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 Alkaline Serine Protease Kp-43 From Bacillus Sp. Ksm-KP43 (Oxidized Form, 1.73 Angstrom) within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Ca1003
b:15.3
occ:1.00
|
OE2
|
A:GLU400
|
2.2
|
13.3
|
1.0
|
OD1
|
A:ASP369
|
2.3
|
15.4
|
1.0
|
OD1
|
A:ASP367
|
2.3
|
17.6
|
1.0
|
O
|
A:ASP394
|
2.3
|
15.0
|
1.0
|
O
|
A:LEU368
|
2.4
|
13.6
|
1.0
|
O
|
A:HOH3004
|
2.4
|
16.4
|
1.0
|
C
|
A:LEU368
|
3.3
|
13.4
|
1.0
|
CD
|
A:GLU400
|
3.3
|
12.6
|
1.0
|
CG
|
A:ASP367
|
3.5
|
16.6
|
1.0
|
C
|
A:ASP394
|
3.5
|
16.0
|
1.0
|
CG
|
A:ASP369
|
3.5
|
14.7
|
1.0
|
CA
|
A:ASP369
|
3.8
|
13.7
|
1.0
|
N
|
A:ASP369
|
3.9
|
14.6
|
1.0
|
OD2
|
A:ASP367
|
4.0
|
19.3
|
1.0
|
O
|
A:HOH3170
|
4.0
|
22.1
|
1.0
|
OE1
|
A:GLU400
|
4.1
|
14.1
|
1.0
|
N
|
A:LEU368
|
4.2
|
15.3
|
1.0
|
CB
|
A:ASP369
|
4.2
|
14.1
|
1.0
|
CG
|
A:GLU400
|
4.3
|
12.8
|
1.0
|
O
|
A:HOH3053
|
4.3
|
18.1
|
1.0
|
CB
|
A:ASP394
|
4.3
|
14.8
|
1.0
|
CA
|
A:ASP394
|
4.3
|
15.9
|
1.0
|
N
|
A:GLY395
|
4.4
|
15.6
|
1.0
|
OD2
|
A:ASP369
|
4.4
|
17.6
|
1.0
|
CA
|
A:LEU368
|
4.4
|
13.7
|
1.0
|
OD1
|
A:ASP394
|
4.4
|
15.4
|
1.0
|
CH2
|
A:TRP351
|
4.5
|
14.7
|
1.0
|
CA
|
A:GLY395
|
4.6
|
16.3
|
1.0
|
C
|
A:ASP367
|
4.6
|
15.3
|
1.0
|
N
|
A:ASP394
|
4.6
|
18.6
|
1.0
|
CB
|
A:ASP367
|
4.7
|
15.0
|
1.0
|
CG
|
A:ASP394
|
4.8
|
15.2
|
1.0
|
CA
|
A:ASP367
|
4.8
|
15.2
|
1.0
|
O
|
A:ASN397
|
4.8
|
14.9
|
1.0
|
CZ2
|
A:TRP351
|
5.0
|
14.8
|
1.0
|
|
Reference:
T.Nonaka,
M.Fujihashi,
A.Kita,
K.Saeki,
S.Ito,
K.Horikoshi,
K.Miki.
The Crystal Structure of An Oxidatively Stable Subtilisin-Like Alkaline Serine Protease, Kp-43, with A C-Terminal {Beta}-Barrel Domain J.Biol.Chem. V. 279 47344 2004.
ISSN: ISSN 0021-9258
PubMed: 15342641
DOI: 10.1074/JBC.M409089200
Page generated: Fri Jul 12 07:12:40 2024
|