Zinc in PDB 2p2l: RAC1-Gdp-Zinc Complex
Protein crystallography data
The structure of RAC1-Gdp-Zinc Complex, PDB code: 2p2l
was solved by
G.Prehna,
C.E.Stebbins,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
77.62 /
1.90
|
Space group
|
P 32 2 1
|
Cell size a, b, c (Å), α, β, γ (°)
|
89.727,
89.727,
190.618,
90.00,
90.00,
120.00
|
R / Rfree (%)
|
17.6 /
20.8
|
Zinc Binding Sites:
The binding sites of Zinc atom in the RAC1-Gdp-Zinc Complex
(pdb code 2p2l). This binding sites where shown within
5.0 Angstroms radius around Zinc atom.
In total 8 binding sites of Zinc where determined in the
RAC1-Gdp-Zinc Complex, PDB code: 2p2l:
Jump to Zinc binding site number:
1;
2;
3;
4;
5;
6;
7;
8;
Zinc binding site 1 out
of 8 in 2p2l
Go back to
Zinc Binding Sites List in 2p2l
Zinc binding site 1 out
of 8 in the RAC1-Gdp-Zinc Complex
Mono view
Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 1 of RAC1-Gdp-Zinc Complex within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Zn201
b:26.3
occ:1.00
|
O3B
|
A:GDP200
|
2.1
|
15.6
|
1.0
|
O
|
A:HOH1114
|
2.1
|
15.9
|
1.0
|
O
|
A:HOH1148
|
2.1
|
18.8
|
1.0
|
OG1
|
A:THR17
|
2.2
|
25.2
|
1.0
|
O
|
A:HOH915
|
2.2
|
16.4
|
1.0
|
O
|
A:THR35
|
2.3
|
26.3
|
1.0
|
CB
|
A:THR17
|
3.2
|
24.9
|
1.0
|
PB
|
A:GDP200
|
3.3
|
17.9
|
1.0
|
C
|
A:THR35
|
3.3
|
26.4
|
1.0
|
O1B
|
A:GDP200
|
3.5
|
19.4
|
1.0
|
N
|
A:THR17
|
4.0
|
25.7
|
1.0
|
OD2
|
A:ASP57
|
4.0
|
28.1
|
1.0
|
O
|
A:PRO34
|
4.0
|
24.6
|
1.0
|
O2A
|
A:GDP200
|
4.1
|
18.4
|
1.0
|
CA
|
A:THR35
|
4.1
|
25.8
|
1.0
|
CA
|
A:THR17
|
4.2
|
25.3
|
1.0
|
CG2
|
A:THR17
|
4.3
|
25.5
|
1.0
|
OD1
|
A:ASP57
|
4.3
|
28.1
|
1.0
|
N
|
A:VAL36
|
4.3
|
26.2
|
1.0
|
O
|
A:HOH1083
|
4.3
|
35.5
|
1.0
|
O3A
|
A:GDP200
|
4.4
|
17.8
|
1.0
|
O2B
|
A:GDP200
|
4.4
|
15.8
|
1.0
|
PA
|
A:GDP200
|
4.5
|
18.4
|
1.0
|
O
|
A:HOH905
|
4.5
|
21.1
|
1.0
|
O
|
A:HOH1149
|
4.5
|
37.5
|
1.0
|
O
|
A:THR58
|
4.5
|
31.7
|
1.0
|
CG
|
A:ASP57
|
4.5
|
28.6
|
1.0
|
CA
|
A:VAL36
|
4.6
|
26.0
|
1.0
|
O1A
|
A:GDP200
|
4.7
|
19.9
|
1.0
|
C
|
A:PRO34
|
4.9
|
25.7
|
1.0
|
NZ
|
A:LYS16
|
4.9
|
24.1
|
1.0
|
O
|
A:HOH965
|
4.9
|
27.3
|
1.0
|
|
Zinc binding site 2 out
of 8 in 2p2l
Go back to
Zinc Binding Sites List in 2p2l
Zinc binding site 2 out
of 8 in the RAC1-Gdp-Zinc Complex
Mono view
Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 2 of RAC1-Gdp-Zinc Complex within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Zn202
b:28.5
occ:1.00
|
OD2
|
A:ASP63
|
2.0
|
25.7
|
1.0
|
NE2
|
A:HIS104
|
2.0
|
25.9
|
1.0
|
OE2
|
A:GLU100
|
2.1
|
26.2
|
1.0
|
CG
|
A:ASP63
|
2.6
|
25.3
|
1.0
|
OD1
|
A:ASP63
|
2.7
|
21.9
|
1.0
|
CD
|
A:GLU100
|
2.8
|
28.6
|
1.0
|
OE1
|
A:GLU100
|
2.9
|
29.6
|
1.0
|
CD2
|
A:HIS104
|
3.0
|
25.9
|
1.0
|
CE1
|
A:HIS104
|
3.0
|
24.6
|
1.0
|
CB
|
A:ASP63
|
4.1
|
25.5
|
1.0
|
ND1
|
A:HIS104
|
4.1
|
23.8
|
1.0
|
CG
|
A:HIS104
|
4.1
|
24.7
|
1.0
|
NE2
|
A:GLN61
|
4.2
|
29.0
|
1.0
|
CG
|
A:GLU100
|
4.3
|
26.6
|
1.0
|
N
|
A:ASP63
|
4.3
|
26.3
|
1.0
|
CB
|
A:GLU62
|
4.6
|
27.1
|
1.0
|
CD2
|
A:HIS103
|
4.6
|
19.6
|
1.0
|
CG
|
A:GLN61
|
4.6
|
31.9
|
1.0
|
CA
|
A:GLU100
|
4.6
|
26.9
|
1.0
|
CB
|
A:GLU100
|
4.7
|
27.1
|
1.0
|
CA
|
A:ASP63
|
4.7
|
26.1
|
1.0
|
O
|
A:HOH968
|
4.8
|
27.3
|
1.0
|
O
|
A:HOH923
|
4.8
|
28.8
|
1.0
|
CB
|
A:HIS103
|
4.9
|
23.8
|
1.0
|
CD
|
A:GLN61
|
4.9
|
34.0
|
1.0
|
CG
|
A:GLU62
|
4.9
|
27.3
|
1.0
|
O
|
A:GLU100
|
5.0
|
26.8
|
1.0
|
CG
|
A:HIS103
|
5.0
|
21.2
|
1.0
|
|
Zinc binding site 3 out
of 8 in 2p2l
Go back to
Zinc Binding Sites List in 2p2l
Zinc binding site 3 out
of 8 in the RAC1-Gdp-Zinc Complex
Mono view
Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 3 of RAC1-Gdp-Zinc Complex within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Zn901
b:28.1
occ:1.00
|
OD1
|
A:ASP38
|
2.0
|
23.8
|
1.0
|
O
|
A:HOH1125
|
2.0
|
19.5
|
1.0
|
OD1
|
B:ASP38
|
2.0
|
23.9
|
1.0
|
OD1
|
C:ASP38
|
2.0
|
26.1
|
1.0
|
CG
|
A:ASP38
|
2.7
|
24.9
|
1.0
|
CG
|
C:ASP38
|
2.7
|
24.8
|
1.0
|
OD2
|
A:ASP38
|
2.7
|
24.9
|
1.0
|
CG
|
B:ASP38
|
2.7
|
21.6
|
1.0
|
OD2
|
C:ASP38
|
2.7
|
28.0
|
1.0
|
OD2
|
B:ASP38
|
2.8
|
24.9
|
1.0
|
O
|
A:HOH1156
|
3.2
|
46.0
|
1.0
|
O
|
A:HOH989
|
3.9
|
26.3
|
1.0
|
O
|
B:HOH231
|
3.9
|
25.5
|
1.0
|
O
|
C:HOH273
|
4.0
|
26.4
|
1.0
|
CB
|
A:ASP38
|
4.2
|
26.0
|
1.0
|
CB
|
B:ASP38
|
4.2
|
24.1
|
1.0
|
CB
|
C:ASP38
|
4.2
|
25.3
|
1.0
|
O
|
C:HOH207
|
4.3
|
19.0
|
1.0
|
O
|
B:HOH234
|
4.3
|
22.0
|
1.0
|
O
|
C:HOH219
|
4.3
|
25.7
|
1.0
|
O
|
A:HOH1173
|
4.6
|
38.9
|
1.0
|
O
|
B:HOH251
|
4.7
|
36.6
|
1.0
|
O
|
B:HOH216
|
4.7
|
23.7
|
1.0
|
O
|
C:HOH246
|
4.7
|
29.0
|
1.0
|
O
|
C:HOH264
|
4.8
|
40.9
|
1.0
|
O
|
A:HOH959
|
4.8
|
26.6
|
1.0
|
|
Zinc binding site 4 out
of 8 in 2p2l
Go back to
Zinc Binding Sites List in 2p2l
Zinc binding site 4 out
of 8 in the RAC1-Gdp-Zinc Complex
Mono view
Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 4 of RAC1-Gdp-Zinc Complex within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Zn902
b:49.1
occ:1.00
|
OE2
|
A:GLU131
|
2.0
|
32.0
|
1.0
|
OE1
|
A:GLU127
|
2.1
|
32.7
|
1.0
|
CD
|
A:GLU131
|
2.9
|
32.0
|
1.0
|
CD
|
A:GLU127
|
3.1
|
31.6
|
1.0
|
CG
|
A:GLU131
|
3.1
|
32.0
|
1.0
|
CG
|
A:GLU127
|
3.3
|
29.1
|
1.0
|
O
|
A:HOH1136
|
4.0
|
55.8
|
1.0
|
OE1
|
A:GLU131
|
4.1
|
32.4
|
1.0
|
OE2
|
A:GLU127
|
4.2
|
33.8
|
1.0
|
NZ
|
A:LYS130
|
4.3
|
39.4
|
1.0
|
O
|
A:GLU127
|
4.6
|
28.5
|
1.0
|
CB
|
A:GLU131
|
4.7
|
31.4
|
1.0
|
CB
|
A:GLU127
|
4.8
|
29.3
|
1.0
|
|
Zinc binding site 5 out
of 8 in 2p2l
Go back to
Zinc Binding Sites List in 2p2l
Zinc binding site 5 out
of 8 in the RAC1-Gdp-Zinc Complex
Mono view
Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 5 of RAC1-Gdp-Zinc Complex within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Zn201
b:28.6
occ:1.00
|
O
|
B:HOH431
|
2.1
|
17.3
|
1.0
|
O
|
B:HOH421
|
2.1
|
18.3
|
1.0
|
OG1
|
B:THR17
|
2.2
|
26.4
|
1.0
|
O3B
|
B:GDP200
|
2.2
|
19.6
|
1.0
|
O
|
B:HOH412
|
2.2
|
19.9
|
1.0
|
O
|
B:THR35
|
2.3
|
27.9
|
1.0
|
CB
|
B:THR17
|
3.2
|
26.6
|
1.0
|
PB
|
B:GDP200
|
3.3
|
20.0
|
1.0
|
C
|
B:THR35
|
3.3
|
27.8
|
1.0
|
O1B
|
B:GDP200
|
3.5
|
20.4
|
1.0
|
OD2
|
B:ASP57
|
3.9
|
29.1
|
1.0
|
N
|
B:THR17
|
4.0
|
26.5
|
1.0
|
O
|
B:PRO34
|
4.0
|
27.0
|
1.0
|
CA
|
B:THR35
|
4.1
|
27.3
|
1.0
|
O2A
|
B:GDP200
|
4.1
|
20.4
|
1.0
|
CA
|
B:THR17
|
4.1
|
26.5
|
1.0
|
CG2
|
B:THR17
|
4.2
|
26.2
|
1.0
|
OD1
|
B:ASP57
|
4.3
|
29.5
|
1.0
|
N
|
B:VAL36
|
4.3
|
27.2
|
1.0
|
O3A
|
B:GDP200
|
4.3
|
20.4
|
1.0
|
O2B
|
B:GDP200
|
4.4
|
19.4
|
1.0
|
O
|
B:HOH327
|
4.4
|
34.0
|
1.0
|
PA
|
B:GDP200
|
4.5
|
21.8
|
1.0
|
CG
|
B:ASP57
|
4.5
|
29.3
|
1.0
|
O
|
B:THR58
|
4.5
|
32.3
|
1.0
|
CA
|
B:VAL36
|
4.6
|
27.6
|
1.0
|
O
|
B:HOH205
|
4.6
|
23.3
|
1.0
|
O
|
B:HOH339
|
4.7
|
42.7
|
1.0
|
O1A
|
B:GDP200
|
4.8
|
22.4
|
1.0
|
NZ
|
B:LYS16
|
4.9
|
24.4
|
1.0
|
C
|
B:PRO34
|
4.9
|
27.7
|
1.0
|
CB
|
B:LYS16
|
5.0
|
27.6
|
1.0
|
|
Zinc binding site 6 out
of 8 in 2p2l
Go back to
Zinc Binding Sites List in 2p2l
Zinc binding site 6 out
of 8 in the RAC1-Gdp-Zinc Complex
Mono view
Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 6 of RAC1-Gdp-Zinc Complex within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Zn202
b:30.6
occ:1.00
|
OD2
|
B:ASP63
|
2.0
|
25.9
|
1.0
|
NE2
|
B:HIS104
|
2.0
|
23.5
|
1.0
|
OE2
|
B:GLU100
|
2.1
|
27.1
|
1.0
|
CG
|
B:ASP63
|
2.7
|
25.0
|
1.0
|
OD1
|
B:ASP63
|
2.8
|
22.6
|
1.0
|
CD
|
B:GLU100
|
2.8
|
28.3
|
1.0
|
CD2
|
B:HIS104
|
2.9
|
26.6
|
1.0
|
OE1
|
B:GLU100
|
2.9
|
30.1
|
1.0
|
CE1
|
B:HIS104
|
3.0
|
26.6
|
1.0
|
CG
|
B:HIS104
|
4.1
|
25.7
|
1.0
|
ND1
|
B:HIS104
|
4.1
|
25.0
|
1.0
|
CB
|
B:ASP63
|
4.1
|
26.5
|
1.0
|
NE2
|
B:GLN61
|
4.2
|
28.1
|
1.0
|
CG
|
B:GLU100
|
4.2
|
27.5
|
1.0
|
N
|
B:ASP63
|
4.3
|
27.3
|
1.0
|
CB
|
B:GLU62
|
4.5
|
28.8
|
1.0
|
CA
|
B:GLU100
|
4.6
|
26.8
|
1.0
|
CB
|
B:GLU100
|
4.7
|
26.3
|
1.0
|
CD2
|
B:HIS103
|
4.7
|
23.5
|
1.0
|
CG
|
B:GLN61
|
4.7
|
32.1
|
1.0
|
CA
|
B:ASP63
|
4.7
|
26.8
|
1.0
|
CG
|
B:GLU62
|
4.9
|
27.4
|
1.0
|
O
|
B:HOH305
|
4.9
|
38.6
|
1.0
|
CB
|
B:HIS103
|
4.9
|
24.6
|
1.0
|
CD
|
B:GLN61
|
4.9
|
33.4
|
1.0
|
O
|
B:GLU100
|
4.9
|
26.5
|
1.0
|
|
Zinc binding site 7 out
of 8 in 2p2l
Go back to
Zinc Binding Sites List in 2p2l
Zinc binding site 7 out
of 8 in the RAC1-Gdp-Zinc Complex
Mono view
Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 7 of RAC1-Gdp-Zinc Complex within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:Zn201
b:26.9
occ:1.00
|
O3B
|
C:GDP200
|
2.1
|
18.9
|
1.0
|
O
|
C:HOH443
|
2.1
|
15.9
|
1.0
|
O
|
C:HOH434
|
2.1
|
17.3
|
1.0
|
OG1
|
C:THR17
|
2.2
|
25.2
|
1.0
|
O
|
C:HOH424
|
2.2
|
19.3
|
1.0
|
O
|
C:THR35
|
2.2
|
25.4
|
1.0
|
CB
|
C:THR17
|
3.2
|
26.7
|
1.0
|
PB
|
C:GDP200
|
3.3
|
19.3
|
1.0
|
C
|
C:THR35
|
3.3
|
26.5
|
1.0
|
O1B
|
C:GDP200
|
3.4
|
19.9
|
1.0
|
N
|
C:THR17
|
4.0
|
25.4
|
1.0
|
OD2
|
C:ASP57
|
4.0
|
26.0
|
1.0
|
O
|
C:PRO34
|
4.0
|
26.3
|
1.0
|
CA
|
C:THR35
|
4.0
|
26.2
|
1.0
|
O2A
|
C:GDP200
|
4.1
|
19.0
|
1.0
|
CA
|
C:THR17
|
4.1
|
25.8
|
1.0
|
CG2
|
C:THR17
|
4.2
|
25.3
|
1.0
|
OD1
|
C:ASP57
|
4.3
|
26.4
|
1.0
|
N
|
C:VAL36
|
4.3
|
26.5
|
1.0
|
O3A
|
C:GDP200
|
4.3
|
19.7
|
1.0
|
O2B
|
C:GDP200
|
4.3
|
18.8
|
1.0
|
O
|
B:HOH420
|
4.4
|
35.0
|
1.0
|
PA
|
C:GDP200
|
4.5
|
19.2
|
1.0
|
O
|
B:HOH330
|
4.5
|
33.7
|
1.0
|
O
|
C:HOH211
|
4.5
|
22.3
|
1.0
|
CG
|
C:ASP57
|
4.6
|
28.2
|
1.0
|
O
|
C:THR58
|
4.6
|
30.0
|
1.0
|
CA
|
C:VAL36
|
4.6
|
26.1
|
1.0
|
O1A
|
C:GDP200
|
4.7
|
17.9
|
1.0
|
NZ
|
C:LYS16
|
4.8
|
24.7
|
1.0
|
C
|
C:PRO34
|
4.9
|
26.3
|
1.0
|
CB
|
C:LYS16
|
5.0
|
25.2
|
1.0
|
O
|
C:HOH209
|
5.0
|
25.1
|
1.0
|
|
Zinc binding site 8 out
of 8 in 2p2l
Go back to
Zinc Binding Sites List in 2p2l
Zinc binding site 8 out
of 8 in the RAC1-Gdp-Zinc Complex
Mono view
Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 8 of RAC1-Gdp-Zinc Complex within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:Zn202
b:31.6
occ:1.00
|
OD2
|
C:ASP63
|
2.0
|
23.8
|
1.0
|
NE2
|
C:HIS104
|
2.0
|
25.4
|
1.0
|
OE2
|
C:GLU100
|
2.1
|
27.5
|
1.0
|
CG
|
C:ASP63
|
2.6
|
24.6
|
1.0
|
OD1
|
C:ASP63
|
2.7
|
23.9
|
1.0
|
CD
|
C:GLU100
|
2.8
|
27.3
|
1.0
|
OE1
|
C:GLU100
|
2.9
|
30.1
|
1.0
|
CD2
|
C:HIS104
|
2.9
|
26.3
|
1.0
|
CE1
|
C:HIS104
|
3.0
|
27.1
|
1.0
|
ND1
|
C:HIS104
|
4.1
|
26.6
|
1.0
|
CG
|
C:HIS104
|
4.1
|
25.9
|
1.0
|
CB
|
C:ASP63
|
4.1
|
25.6
|
1.0
|
NE2
|
C:GLN61
|
4.3
|
29.9
|
1.0
|
CG
|
C:GLU100
|
4.3
|
28.1
|
1.0
|
N
|
C:ASP63
|
4.3
|
26.3
|
1.0
|
CB
|
C:GLU62
|
4.5
|
25.4
|
1.0
|
CD2
|
C:HIS103
|
4.6
|
23.4
|
1.0
|
CA
|
C:GLU100
|
4.6
|
26.7
|
1.0
|
O
|
C:HOH253
|
4.7
|
28.2
|
1.0
|
CA
|
C:ASP63
|
4.7
|
26.7
|
1.0
|
CG
|
C:GLN61
|
4.8
|
30.6
|
1.0
|
CB
|
C:GLU100
|
4.8
|
27.0
|
1.0
|
CB
|
C:HIS103
|
4.9
|
23.1
|
1.0
|
O
|
C:HOH263
|
4.9
|
31.8
|
1.0
|
O
|
C:GLU100
|
5.0
|
25.6
|
1.0
|
CG
|
C:HIS103
|
5.0
|
21.7
|
1.0
|
O
|
C:HOH389
|
5.0
|
36.0
|
1.0
|
|
Reference:
G.Prehna,
C.E.Stebbins.
A RAC1-Gdp Trimer Complex Binds Zinc with Tetrahedral and Octahedral Coordination, Displacing Magnesium. Acta Crystallogr.,Sect.D V. 63 628 2007.
ISSN: ISSN 0907-4449
PubMed: 17452788
DOI: 10.1107/S0907444907010888
Page generated: Thu Oct 17 02:55:30 2024
|