Nickel in PDB 3no4: Crystal Structure of A Creatinine Amidohydrolase (NPUN_F1913) From Nostoc Punctiforme Pcc 73102 at 2.00 A Resolution
Protein crystallography data
The structure of Crystal Structure of A Creatinine Amidohydrolase (NPUN_F1913) From Nostoc Punctiforme Pcc 73102 at 2.00 A Resolution, PDB code: 3no4
was solved by
Joint Center For Structural Genomics (Jcsg),
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
29.70 /
2.00
|
Space group
|
P 41 21 2
|
Cell size a, b, c (Å), α, β, γ (°)
|
89.085,
89.085,
211.563,
90.00,
90.00,
90.00
|
R / Rfree (%)
|
15.1 /
19.2
|
Other elements in 3no4:
The structure of Crystal Structure of A Creatinine Amidohydrolase (NPUN_F1913) From Nostoc Punctiforme Pcc 73102 at 2.00 A Resolution also contains other interesting chemical elements:
Nickel Binding Sites:
The binding sites of Nickel atom in the Crystal Structure of A Creatinine Amidohydrolase (NPUN_F1913) From Nostoc Punctiforme Pcc 73102 at 2.00 A Resolution
(pdb code 3no4). This binding sites where shown within
5.0 Angstroms radius around Nickel atom.
In total 3 binding sites of Nickel where determined in the
Crystal Structure of A Creatinine Amidohydrolase (NPUN_F1913) From Nostoc Punctiforme Pcc 73102 at 2.00 A Resolution, PDB code: 3no4:
Jump to Nickel binding site number:
1;
2;
3;
Nickel binding site 1 out
of 3 in 3no4
Go back to
Nickel Binding Sites List in 3no4
Nickel binding site 1 out
of 3 in the Crystal Structure of A Creatinine Amidohydrolase (NPUN_F1913) From Nostoc Punctiforme Pcc 73102 at 2.00 A Resolution
 Mono view
 Stereo pair view
|
A full contact list of Nickel with other atoms in the Ni binding
site number 1 of Crystal Structure of A Creatinine Amidohydrolase (NPUN_F1913) From Nostoc Punctiforme Pcc 73102 at 2.00 A Resolution within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Ni300
b:29.1
occ:1.00
|
O
|
A:HOH531
|
2.1
|
41.5
|
1.0
|
OE1
|
A:GLU172
|
2.1
|
23.6
|
1.0
|
OD1
|
A:ASP40
|
2.1
|
21.4
|
1.0
|
NE2
|
A:HIS31
|
2.2
|
21.8
|
1.0
|
O
|
A:HOH645
|
2.7
|
48.2
|
1.0
|
CD
|
A:GLU172
|
2.9
|
23.3
|
1.0
|
CG
|
A:ASP40
|
3.0
|
20.9
|
1.0
|
O
|
A:HOH532
|
3.0
|
28.2
|
1.0
|
OE2
|
A:GLU172
|
3.1
|
25.0
|
1.0
|
OD2
|
A:ASP40
|
3.1
|
21.7
|
1.0
|
CE1
|
A:HIS31
|
3.2
|
22.3
|
1.0
|
CD2
|
A:HIS31
|
3.2
|
26.7
|
1.0
|
O
|
A:HOH438
|
4.0
|
21.7
|
1.0
|
CG2
|
A:THR39
|
4.1
|
20.8
|
1.0
|
O
|
A:GLY109
|
4.2
|
22.6
|
1.0
|
ND1
|
A:HIS31
|
4.3
|
20.9
|
1.0
|
CG
|
A:GLU172
|
4.3
|
24.4
|
1.0
|
OE2
|
A:GLU29
|
4.3
|
28.7
|
1.0
|
CG
|
A:HIS31
|
4.3
|
23.7
|
1.0
|
ND1
|
A:HIS167
|
4.3
|
24.9
|
1.0
|
O
|
A:HOH534
|
4.3
|
39.7
|
1.0
|
CE1
|
A:HIS167
|
4.3
|
24.7
|
1.0
|
O
|
A:HOH536
|
4.4
|
49.9
|
1.0
|
CB
|
A:ASP40
|
4.4
|
21.8
|
1.0
|
N
|
A:ASP40
|
4.7
|
21.2
|
1.0
|
CB
|
A:THR39
|
4.8
|
21.4
|
1.0
|
CA
|
A:ASP40
|
4.8
|
21.8
|
1.0
|
CB
|
A:GLU172
|
4.9
|
24.2
|
1.0
|
|
Nickel binding site 2 out
of 3 in 3no4
Go back to
Nickel Binding Sites List in 3no4
Nickel binding site 2 out
of 3 in the Crystal Structure of A Creatinine Amidohydrolase (NPUN_F1913) From Nostoc Punctiforme Pcc 73102 at 2.00 A Resolution
 Mono view
 Stereo pair view
|
A full contact list of Nickel with other atoms in the Ni binding
site number 2 of Crystal Structure of A Creatinine Amidohydrolase (NPUN_F1913) From Nostoc Punctiforme Pcc 73102 at 2.00 A Resolution within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Ni300
b:30.7
occ:1.00
|
OE1
|
B:GLU172
|
2.0
|
24.0
|
1.0
|
OD1
|
B:ASP40
|
2.1
|
24.3
|
1.0
|
O
|
B:HOH742
|
2.1
|
54.4
|
1.0
|
NE2
|
B:HIS31
|
2.1
|
26.1
|
1.0
|
O
|
B:HOH739
|
2.5
|
42.4
|
1.0
|
O
|
B:HOH736
|
2.9
|
26.1
|
1.0
|
CD
|
B:GLU172
|
2.9
|
24.5
|
1.0
|
CG
|
B:ASP40
|
2.9
|
21.2
|
1.0
|
CE1
|
B:HIS31
|
3.1
|
23.9
|
1.0
|
OD2
|
B:ASP40
|
3.1
|
23.1
|
1.0
|
OE2
|
B:GLU172
|
3.1
|
24.4
|
1.0
|
CD2
|
B:HIS31
|
3.2
|
25.6
|
1.0
|
O
|
B:HOH738
|
4.0
|
33.0
|
1.0
|
CG2
|
B:THR39
|
4.1
|
20.1
|
1.0
|
O
|
B:HOH719
|
4.1
|
27.6
|
1.0
|
OE2
|
B:GLU29
|
4.1
|
30.6
|
1.0
|
O
|
B:GLY109
|
4.2
|
23.4
|
1.0
|
ND1
|
B:HIS31
|
4.2
|
24.1
|
1.0
|
CE1
|
B:HIS167
|
4.2
|
23.8
|
1.0
|
CG
|
B:HIS31
|
4.3
|
23.1
|
1.0
|
ND1
|
B:HIS167
|
4.3
|
25.2
|
1.0
|
CG
|
B:GLU172
|
4.3
|
25.3
|
1.0
|
CB
|
B:ASP40
|
4.4
|
22.6
|
1.0
|
O1
|
B:UNL350
|
4.6
|
51.0
|
1.0
|
O
|
B:HOH740
|
4.7
|
43.9
|
1.0
|
CB
|
B:THR39
|
4.7
|
23.6
|
1.0
|
N
|
B:ASP40
|
4.7
|
22.2
|
1.0
|
CA
|
B:ASP40
|
4.8
|
21.8
|
1.0
|
CB
|
B:GLU172
|
4.9
|
25.3
|
1.0
|
N
|
B:ALA168
|
5.0
|
26.3
|
1.0
|
|
Nickel binding site 3 out
of 3 in 3no4
Go back to
Nickel Binding Sites List in 3no4
Nickel binding site 3 out
of 3 in the Crystal Structure of A Creatinine Amidohydrolase (NPUN_F1913) From Nostoc Punctiforme Pcc 73102 at 2.00 A Resolution
 Mono view
 Stereo pair view
|
A full contact list of Nickel with other atoms in the Ni binding
site number 3 of Crystal Structure of A Creatinine Amidohydrolase (NPUN_F1913) From Nostoc Punctiforme Pcc 73102 at 2.00 A Resolution within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:Ni300
b:29.6
occ:1.00
|
O
|
C:HOH911
|
2.0
|
39.9
|
1.0
|
OD1
|
C:ASP40
|
2.0
|
24.4
|
1.0
|
OE1
|
C:GLU172
|
2.1
|
23.9
|
1.0
|
NE2
|
C:HIS31
|
2.1
|
24.1
|
1.0
|
O
|
C:HOH913
|
2.5
|
37.9
|
1.0
|
CD
|
C:GLU172
|
2.9
|
25.5
|
1.0
|
O
|
C:HOH909
|
2.9
|
27.1
|
1.0
|
CG
|
C:ASP40
|
2.9
|
21.8
|
1.0
|
OE2
|
C:GLU172
|
3.1
|
23.7
|
1.0
|
CE1
|
C:HIS31
|
3.1
|
24.4
|
1.0
|
OD2
|
C:ASP40
|
3.1
|
22.5
|
1.0
|
CD2
|
C:HIS31
|
3.2
|
23.1
|
1.0
|
O
|
C:HOH868
|
3.9
|
26.7
|
1.0
|
O
|
C:HOH910
|
4.1
|
31.5
|
1.0
|
OE2
|
C:GLU29
|
4.2
|
29.1
|
1.0
|
O
|
C:GLY109
|
4.2
|
21.6
|
1.0
|
ND1
|
C:HIS31
|
4.2
|
24.0
|
1.0
|
CG2
|
C:THR39
|
4.2
|
23.0
|
1.0
|
ND1
|
C:HIS167
|
4.3
|
24.5
|
1.0
|
CG
|
C:GLU172
|
4.3
|
25.6
|
1.0
|
CG
|
C:HIS31
|
4.3
|
22.7
|
1.0
|
CE1
|
C:HIS167
|
4.3
|
25.3
|
1.0
|
CB
|
C:ASP40
|
4.3
|
21.9
|
1.0
|
N
|
C:ASP40
|
4.7
|
22.4
|
1.0
|
CB
|
C:THR39
|
4.7
|
22.1
|
1.0
|
CA
|
C:ASP40
|
4.8
|
22.5
|
1.0
|
O
|
C:HOH912
|
4.8
|
45.8
|
1.0
|
CB
|
C:GLU172
|
4.9
|
25.0
|
1.0
|
O3
|
C:UNL350
|
5.0
|
65.0
|
1.0
|
N
|
C:ALA168
|
5.0
|
23.9
|
1.0
|
O
|
C:HOH842
|
5.0
|
20.7
|
1.0
|
|
Reference:
Joint Center For Structural Genomics (Jcsg),
Joint Center For Structural Genomics (Jcsg).
N/A N/A.
Page generated: Wed Oct 9 17:39:40 2024
|