Zinc in PDB 1r0o: Crystal Structure of the Heterodimeric Ecdysone Receptor Dna-Binding Complex
Protein crystallography data
The structure of Crystal Structure of the Heterodimeric Ecdysone Receptor Dna-Binding Complex, PDB code: 1r0o
was solved by
S.Devarakonda,
J.M.Harp,
Y.Kim,
A.Ozyhar,
F.Rastinejad,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
24.77 /
2.24
|
Space group
|
P 21 21 21
|
Cell size a, b, c (Å), α, β, γ (°)
|
50.370,
59.880,
113.770,
90.00,
90.00,
90.00
|
R / Rfree (%)
|
23.2 /
27
|
Zinc Binding Sites:
The binding sites of Zinc atom in the Crystal Structure of the Heterodimeric Ecdysone Receptor Dna-Binding Complex
(pdb code 1r0o). This binding sites where shown within
5.0 Angstroms radius around Zinc atom.
In total 4 binding sites of Zinc where determined in the
Crystal Structure of the Heterodimeric Ecdysone Receptor Dna-Binding Complex, PDB code: 1r0o:
Jump to Zinc binding site number:
1;
2;
3;
4;
Zinc binding site 1 out
of 4 in 1r0o
Go back to
Zinc Binding Sites List in 1r0o
Zinc binding site 1 out
of 4 in the Crystal Structure of the Heterodimeric Ecdysone Receptor Dna-Binding Complex
Mono view
Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 1 of Crystal Structure of the Heterodimeric Ecdysone Receptor Dna-Binding Complex within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Zn351
b:40.9
occ:1.00
|
SG
|
A:CYS27
|
2.2
|
34.5
|
1.0
|
SG
|
A:CYS24
|
2.3
|
29.4
|
1.0
|
SG
|
A:CYS10
|
2.4
|
31.4
|
1.0
|
SG
|
A:CYS7
|
2.4
|
35.9
|
1.0
|
CB
|
A:CYS27
|
3.1
|
34.3
|
1.0
|
CB
|
A:CYS7
|
3.4
|
39.3
|
1.0
|
CB
|
A:CYS24
|
3.5
|
31.1
|
1.0
|
CB
|
A:CYS10
|
3.5
|
32.8
|
1.0
|
N
|
A:CYS10
|
3.8
|
34.6
|
1.0
|
N
|
A:CYS27
|
4.0
|
31.5
|
1.0
|
N
|
A:CYS24
|
4.0
|
36.7
|
1.0
|
CA
|
A:CYS27
|
4.1
|
33.8
|
1.0
|
CA
|
A:CYS10
|
4.3
|
32.9
|
1.0
|
CA
|
A:CYS24
|
4.3
|
34.1
|
1.0
|
NH1
|
A:ARG56
|
4.3
|
30.6
|
1.0
|
CB
|
A:ILE9
|
4.3
|
33.8
|
1.0
|
CB
|
A:ASP12
|
4.5
|
35.6
|
1.0
|
CG2
|
A:ILE9
|
4.5
|
35.4
|
1.0
|
NH2
|
A:ARG63
|
4.7
|
29.7
|
1.0
|
C
|
A:ILE9
|
4.7
|
36.0
|
1.0
|
O
|
A:CYS24
|
4.8
|
31.6
|
1.0
|
CA
|
A:CYS7
|
4.9
|
41.6
|
1.0
|
C
|
A:CYS24
|
4.9
|
32.8
|
1.0
|
CD
|
A:ARG56
|
4.9
|
32.2
|
1.0
|
CA
|
A:ILE9
|
5.0
|
35.8
|
1.0
|
N
|
A:ASP12
|
5.0
|
34.2
|
1.0
|
C
|
A:CYS10
|
5.0
|
32.3
|
1.0
|
|
Zinc binding site 2 out
of 4 in 1r0o
Go back to
Zinc Binding Sites List in 1r0o
Zinc binding site 2 out
of 4 in the Crystal Structure of the Heterodimeric Ecdysone Receptor Dna-Binding Complex
Mono view
Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 2 of Crystal Structure of the Heterodimeric Ecdysone Receptor Dna-Binding Complex within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Zn353
b:50.2
occ:1.00
|
SG
|
A:CYS62
|
2.3
|
41.3
|
1.0
|
SG
|
A:CYS43
|
2.3
|
49.9
|
1.0
|
SG
|
A:CYS59
|
2.4
|
41.0
|
1.0
|
SG
|
A:CYS49
|
2.5
|
38.3
|
1.0
|
CB
|
A:CYS43
|
3.2
|
50.2
|
1.0
|
CB
|
A:CYS49
|
3.3
|
38.5
|
1.0
|
CB
|
A:CYS59
|
3.3
|
37.8
|
1.0
|
CB
|
A:CYS62
|
3.4
|
37.1
|
1.0
|
CA
|
A:CYS43
|
4.0
|
52.0
|
1.0
|
N
|
A:CYS62
|
4.2
|
38.2
|
1.0
|
N
|
A:CYS49
|
4.2
|
45.4
|
1.0
|
O
|
A:HOH357
|
4.2
|
40.4
|
1.0
|
O
|
A:ASN46
|
4.3
|
60.7
|
1.0
|
CA
|
A:CYS49
|
4.3
|
42.1
|
1.0
|
CA
|
A:CYS62
|
4.4
|
37.6
|
1.0
|
O
|
A:HOH433
|
4.4
|
39.7
|
1.0
|
CA
|
A:ARG47
|
4.4
|
54.9
|
1.0
|
C
|
A:ASN46
|
4.7
|
58.9
|
1.0
|
CA
|
A:CYS59
|
4.7
|
37.8
|
1.0
|
N
|
A:ASN48
|
4.8
|
53.1
|
1.0
|
N
|
A:ARG47
|
4.8
|
57.1
|
1.0
|
O
|
A:HOH381
|
4.9
|
35.5
|
1.0
|
C
|
A:CYS43
|
4.9
|
54.0
|
1.0
|
C
|
A:ARG47
|
4.9
|
53.9
|
1.0
|
CB
|
A:TYR61
|
4.9
|
38.7
|
1.0
|
CD2
|
A:TYR61
|
4.9
|
38.7
|
1.0
|
N
|
A:ARG44
|
4.9
|
56.6
|
1.0
|
|
Zinc binding site 3 out
of 4 in 1r0o
Go back to
Zinc Binding Sites List in 1r0o
Zinc binding site 3 out
of 4 in the Crystal Structure of the Heterodimeric Ecdysone Receptor Dna-Binding Complex
Mono view
Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 3 of Crystal Structure of the Heterodimeric Ecdysone Receptor Dna-Binding Complex within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Zn350
b:38.6
occ:1.00
|
SG
|
B:CYS27
|
2.3
|
26.3
|
1.0
|
SG
|
B:CYS10
|
2.4
|
26.6
|
1.0
|
SG
|
B:CYS24
|
2.4
|
26.1
|
1.0
|
SG
|
B:CYS7
|
2.6
|
31.1
|
1.0
|
CB
|
B:CYS27
|
3.3
|
25.5
|
1.0
|
CB
|
B:CYS10
|
3.4
|
27.3
|
1.0
|
CB
|
B:CYS7
|
3.5
|
30.6
|
1.0
|
CB
|
B:CYS24
|
3.6
|
26.5
|
1.0
|
N
|
B:CYS10
|
3.7
|
28.7
|
1.0
|
N
|
B:CYS24
|
4.0
|
25.9
|
1.0
|
N
|
B:CYS27
|
4.0
|
26.4
|
1.0
|
NH1
|
B:ARG56
|
4.1
|
22.4
|
1.0
|
CA
|
B:CYS10
|
4.1
|
28.5
|
1.0
|
CA
|
B:CYS27
|
4.2
|
27.0
|
1.0
|
CB
|
B:VAL9
|
4.3
|
27.3
|
1.0
|
CA
|
B:CYS24
|
4.3
|
25.7
|
1.0
|
CB
|
B:ASP12
|
4.5
|
29.4
|
1.0
|
NH2
|
B:ARG63
|
4.8
|
23.3
|
1.0
|
C
|
B:VAL9
|
4.8
|
28.9
|
1.0
|
CG1
|
B:VAL9
|
4.8
|
24.7
|
1.0
|
CD
|
B:ARG56
|
4.8
|
24.1
|
1.0
|
C
|
B:CYS10
|
4.8
|
27.8
|
1.0
|
C
|
B:CYS24
|
4.9
|
27.5
|
1.0
|
CA
|
B:CYS7
|
4.9
|
33.9
|
1.0
|
N
|
B:ASP12
|
4.9
|
30.3
|
1.0
|
O
|
B:CYS24
|
4.9
|
28.1
|
1.0
|
N
|
B:GLY11
|
5.0
|
29.7
|
1.0
|
CA
|
B:VAL9
|
5.0
|
27.3
|
1.0
|
|
Zinc binding site 4 out
of 4 in 1r0o
Go back to
Zinc Binding Sites List in 1r0o
Zinc binding site 4 out
of 4 in the Crystal Structure of the Heterodimeric Ecdysone Receptor Dna-Binding Complex
Mono view
Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 4 of Crystal Structure of the Heterodimeric Ecdysone Receptor Dna-Binding Complex within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Zn352
b:50.3
occ:1.00
|
SG
|
B:CYS59
|
2.3
|
31.0
|
1.0
|
SG
|
B:CYS62
|
2.3
|
34.7
|
1.0
|
SG
|
B:CYS49
|
2.4
|
34.6
|
1.0
|
SG
|
B:CYS43
|
2.5
|
43.6
|
1.0
|
CB
|
B:CYS62
|
3.2
|
29.2
|
1.0
|
CB
|
B:CYS43
|
3.2
|
42.4
|
1.0
|
CB
|
B:CYS49
|
3.2
|
37.5
|
1.0
|
CB
|
B:CYS59
|
3.4
|
30.2
|
1.0
|
N
|
B:CYS49
|
3.9
|
43.6
|
1.0
|
N
|
B:CYS62
|
4.1
|
31.2
|
1.0
|
CA
|
B:CYS43
|
4.2
|
44.7
|
1.0
|
CA
|
B:CYS49
|
4.2
|
39.3
|
1.0
|
CA
|
B:CYS62
|
4.2
|
30.1
|
1.0
|
CA
|
B:ARG47
|
4.4
|
55.5
|
1.0
|
N
|
B:ARG47
|
4.4
|
55.8
|
1.0
|
O
|
B:HOH375
|
4.4
|
41.2
|
1.0
|
CD1
|
B:PHE45
|
4.4
|
49.6
|
1.0
|
N
|
B:ALA48
|
4.5
|
51.0
|
1.0
|
CB
|
B:PHE45
|
4.6
|
50.8
|
1.0
|
C
|
B:ARG47
|
4.7
|
53.8
|
1.0
|
CA
|
B:CYS59
|
4.8
|
29.4
|
1.0
|
C
|
B:CYS43
|
5.0
|
46.5
|
1.0
|
|
Reference:
S.Devarakonda,
J.M.Harp,
Y.Kim,
A.Ozyhar,
F.Rastinejad.
Structure of the Heterodimeric Ecdysone Receptor Dna-Binding Complex Embo J. V. 22 5827 2003.
ISSN: ISSN 0261-4189
PubMed: 14592980
DOI: 10.1093/EMBOJ/CDG569
Page generated: Wed Oct 16 18:18:51 2024
|