Magnesium in PDB 5zbs: Crystal Structure of Kinesin-3 KIF13B Motor Y73C Mutant
Protein crystallography data
The structure of Crystal Structure of Kinesin-3 KIF13B Motor Y73C Mutant, PDB code: 5zbs
was solved by
J.Q.Ren,
S.Wang,
W.Feng,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
41.44 /
2.20
|
Space group
|
P 32
|
Cell size a, b, c (Å), α, β, γ (°)
|
107.311,
107.311,
91.599,
90.00,
90.00,
120.00
|
R / Rfree (%)
|
17.2 /
22
|
Magnesium Binding Sites:
The binding sites of Magnesium atom in the Crystal Structure of Kinesin-3 KIF13B Motor Y73C Mutant
(pdb code 5zbs). This binding sites where shown within
5.0 Angstroms radius around Magnesium atom.
In total 5 binding sites of Magnesium where determined in the
Crystal Structure of Kinesin-3 KIF13B Motor Y73C Mutant, PDB code: 5zbs:
Jump to Magnesium binding site number:
1;
2;
3;
4;
5;
Magnesium binding site 1 out
of 5 in 5zbs
Go back to
Magnesium Binding Sites List in 5zbs
Magnesium binding site 1 out
of 5 in the Crystal Structure of Kinesin-3 KIF13B Motor Y73C Mutant
Mono view
Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 1 of Crystal Structure of Kinesin-3 KIF13B Motor Y73C Mutant within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Mg401
b:38.9
occ:1.00
|
O1G
|
B:ANP402
|
2.0
|
23.4
|
0.5
|
O1B
|
B:ANP402
|
2.1
|
31.0
|
1.0
|
O
|
B:HOH526
|
2.1
|
32.1
|
1.0
|
O
|
B:HOH582
|
2.3
|
42.9
|
1.0
|
OG
|
B:SER110
|
2.3
|
36.1
|
1.0
|
O
|
B:HOH506
|
2.4
|
29.9
|
1.0
|
CB
|
B:SER110
|
3.1
|
33.1
|
1.0
|
PG
|
B:ANP402
|
3.2
|
34.0
|
0.5
|
PB
|
B:ANP402
|
3.3
|
35.0
|
1.0
|
N3B
|
B:ANP402
|
3.6
|
37.0
|
1.0
|
N
|
B:SER110
|
3.8
|
27.4
|
1.0
|
O
|
B:HOH622
|
3.9
|
49.4
|
1.0
|
O2G
|
B:ANP402
|
4.0
|
27.3
|
0.5
|
OD1
|
B:ASP253
|
4.0
|
41.5
|
1.0
|
CA
|
B:SER110
|
4.0
|
33.0
|
1.0
|
O2A
|
B:ANP402
|
4.1
|
37.2
|
1.0
|
O2B
|
B:ANP402
|
4.3
|
30.9
|
1.0
|
OD2
|
B:ASP253
|
4.3
|
44.0
|
1.0
|
O3G
|
B:ANP402
|
4.4
|
44.0
|
0.5
|
O3A
|
B:ANP402
|
4.4
|
38.7
|
1.0
|
O1A
|
B:ANP402
|
4.6
|
46.3
|
1.0
|
PA
|
B:ANP402
|
4.7
|
37.1
|
1.0
|
CG
|
B:ASP253
|
4.7
|
40.0
|
1.0
|
CB
|
B:LYS109
|
4.8
|
35.0
|
1.0
|
C
|
B:LYS109
|
4.9
|
37.5
|
1.0
|
|
Magnesium binding site 2 out
of 5 in 5zbs
Go back to
Magnesium Binding Sites List in 5zbs
Magnesium binding site 2 out
of 5 in the Crystal Structure of Kinesin-3 KIF13B Motor Y73C Mutant
Mono view
Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 2 of Crystal Structure of Kinesin-3 KIF13B Motor Y73C Mutant within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Mg402
b:40.8
occ:1.00
|
O1G
|
A:ANP401
|
1.8
|
31.8
|
0.5
|
O
|
A:HOH510
|
2.1
|
31.8
|
1.0
|
O
|
A:HOH507
|
2.2
|
30.0
|
1.0
|
O
|
A:HOH546
|
2.2
|
43.4
|
1.0
|
OG
|
A:SER110
|
2.3
|
37.3
|
1.0
|
O1B
|
A:ANP401
|
2.3
|
28.6
|
1.0
|
CB
|
A:SER110
|
3.1
|
27.6
|
1.0
|
PG
|
A:ANP401
|
3.2
|
39.4
|
0.5
|
PB
|
A:ANP401
|
3.5
|
27.7
|
1.0
|
N3B
|
A:ANP401
|
3.7
|
31.5
|
1.0
|
OD2
|
A:ASP253
|
4.0
|
37.3
|
1.0
|
O2A
|
A:ANP401
|
4.0
|
38.4
|
1.0
|
N
|
A:SER110
|
4.0
|
23.6
|
1.0
|
O
|
A:HOH597
|
4.0
|
48.0
|
1.0
|
O2G
|
A:ANP401
|
4.1
|
59.9
|
0.5
|
CA
|
A:SER110
|
4.1
|
28.7
|
1.0
|
O3G
|
A:ANP401
|
4.2
|
31.9
|
0.5
|
O
|
A:HOH572
|
4.2
|
69.7
|
1.0
|
OD1
|
A:ASP253
|
4.5
|
40.2
|
1.0
|
O3A
|
A:ANP401
|
4.5
|
27.8
|
1.0
|
PA
|
A:ANP401
|
4.6
|
38.0
|
1.0
|
O2B
|
A:ANP401
|
4.7
|
31.2
|
1.0
|
CG
|
A:ASP253
|
4.7
|
39.2
|
1.0
|
O1A
|
A:ANP401
|
4.7
|
30.7
|
1.0
|
NH1
|
A:ARG208
|
4.9
|
68.2
|
1.0
|
|
Magnesium binding site 3 out
of 5 in 5zbs
Go back to
Magnesium Binding Sites List in 5zbs
Magnesium binding site 3 out
of 5 in the Crystal Structure of Kinesin-3 KIF13B Motor Y73C Mutant
Mono view
Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 3 of Crystal Structure of Kinesin-3 KIF13B Motor Y73C Mutant within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Mg403
b:42.3
occ:1.00
|
O
|
A:HOH571
|
2.8
|
25.2
|
1.0
|
O
|
A:GLN76
|
3.0
|
29.0
|
1.0
|
C
|
A:GLY121
|
3.3
|
31.3
|
1.0
|
CD
|
A:ARG125
|
3.3
|
30.6
|
1.0
|
N
|
A:LEU122
|
3.3
|
26.4
|
1.0
|
NE
|
A:ARG125
|
3.4
|
37.4
|
1.0
|
CA
|
A:GLY121
|
3.6
|
29.4
|
1.0
|
O
|
A:GLY121
|
3.6
|
32.7
|
1.0
|
CA
|
A:LEU122
|
3.7
|
31.1
|
1.0
|
CB
|
A:PHE80
|
3.8
|
34.0
|
1.0
|
N
|
A:PHE80
|
3.8
|
31.8
|
1.0
|
C
|
A:GLN76
|
3.8
|
29.5
|
1.0
|
CG
|
A:LEU122
|
3.9
|
38.4
|
1.0
|
CD2
|
A:LEU122
|
4.0
|
32.1
|
1.0
|
CA
|
A:GLN76
|
4.1
|
21.5
|
1.0
|
CA
|
A:PHE80
|
4.2
|
40.3
|
1.0
|
CB
|
A:GLN76
|
4.2
|
29.2
|
1.0
|
O
|
A:PRO120
|
4.2
|
30.5
|
1.0
|
CB
|
A:VAL79
|
4.3
|
32.6
|
1.0
|
CB
|
A:LEU122
|
4.4
|
32.9
|
1.0
|
CZ
|
A:ARG125
|
4.4
|
36.0
|
1.0
|
CG1
|
A:VAL79
|
4.4
|
31.0
|
1.0
|
OE1
|
A:GLN76
|
4.5
|
31.6
|
1.0
|
CG
|
A:ARG125
|
4.6
|
29.3
|
1.0
|
C
|
A:VAL79
|
4.6
|
35.7
|
1.0
|
CD
|
A:GLN76
|
4.7
|
27.8
|
1.0
|
N
|
A:GLY121
|
4.7
|
31.7
|
1.0
|
O
|
A:THR112
|
4.7
|
29.8
|
1.0
|
CD1
|
A:PHE80
|
4.7
|
36.4
|
1.0
|
CG
|
A:PHE80
|
4.7
|
36.8
|
1.0
|
C
|
A:PRO120
|
4.9
|
32.4
|
1.0
|
CA
|
A:VAL79
|
5.0
|
36.9
|
1.0
|
N
|
A:ASP77
|
5.0
|
29.5
|
1.0
|
C
|
A:LEU122
|
5.0
|
35.0
|
1.0
|
|
Magnesium binding site 4 out
of 5 in 5zbs
Go back to
Magnesium Binding Sites List in 5zbs
Magnesium binding site 4 out
of 5 in the Crystal Structure of Kinesin-3 KIF13B Motor Y73C Mutant
Mono view
Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 4 of Crystal Structure of Kinesin-3 KIF13B Motor Y73C Mutant within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:Mg402
b:44.8
occ:1.00
|
O1G
|
C:ANP401
|
1.8
|
39.0
|
0.5
|
O
|
C:HOH506
|
2.0
|
37.7
|
1.0
|
O
|
C:HOH520
|
2.0
|
38.0
|
1.0
|
OG
|
C:SER110
|
2.0
|
44.7
|
1.0
|
O1B
|
C:ANP401
|
2.3
|
31.9
|
1.0
|
CB
|
C:SER110
|
3.2
|
36.4
|
1.0
|
PG
|
C:ANP401
|
3.3
|
39.9
|
0.5
|
PB
|
C:ANP401
|
3.7
|
39.6
|
1.0
|
N3B
|
C:ANP401
|
3.9
|
41.7
|
1.0
|
O3G
|
C:ANP401
|
4.1
|
54.6
|
0.5
|
OD1
|
C:ASP253
|
4.1
|
51.2
|
1.0
|
N
|
C:SER110
|
4.1
|
32.2
|
1.0
|
O2A
|
C:ANP401
|
4.1
|
41.6
|
1.0
|
CA
|
C:SER110
|
4.2
|
34.0
|
1.0
|
O2G
|
C:ANP401
|
4.3
|
26.8
|
0.5
|
OD2
|
C:ASP253
|
4.4
|
48.1
|
1.0
|
O3A
|
C:ANP401
|
4.6
|
37.2
|
1.0
|
CG
|
C:ASP253
|
4.7
|
48.3
|
1.0
|
O
|
C:HOH509
|
4.7
|
63.0
|
1.0
|
O2B
|
C:ANP401
|
4.7
|
32.9
|
1.0
|
PA
|
C:ANP401
|
4.8
|
36.7
|
1.0
|
O1A
|
C:ANP401
|
5.0
|
39.1
|
1.0
|
|
Magnesium binding site 5 out
of 5 in 5zbs
Go back to
Magnesium Binding Sites List in 5zbs
Magnesium binding site 5 out
of 5 in the Crystal Structure of Kinesin-3 KIF13B Motor Y73C Mutant
Mono view
Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 5 of Crystal Structure of Kinesin-3 KIF13B Motor Y73C Mutant within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:Mg403
b:81.4
occ:1.00
|
O
|
C:ILE276
|
2.8
|
58.6
|
1.0
|
N
|
C:ASN155
|
2.8
|
54.1
|
1.0
|
O
|
C:ARG221
|
3.1
|
54.5
|
1.0
|
O
|
C:HOH555
|
3.2
|
54.5
|
1.0
|
CA
|
C:TYR154
|
3.6
|
53.6
|
1.0
|
O
|
C:HOH543
|
3.6
|
50.4
|
1.0
|
C
|
C:TYR154
|
3.6
|
53.6
|
1.0
|
CA
|
C:ASN155
|
3.7
|
53.8
|
1.0
|
C
|
C:ILE276
|
3.9
|
61.5
|
1.0
|
O
|
C:ILE153
|
4.1
|
45.2
|
1.0
|
CD1
|
C:TYR154
|
4.2
|
70.2
|
1.0
|
C
|
C:ARG221
|
4.2
|
60.7
|
1.0
|
N
|
C:GLU156
|
4.4
|
61.4
|
1.0
|
N
|
C:TYR154
|
4.4
|
46.9
|
1.0
|
CA
|
C:ILE276
|
4.4
|
62.3
|
1.0
|
NE2
|
C:HIS223
|
4.4
|
45.2
|
1.0
|
CD2
|
C:HIS223
|
4.4
|
47.1
|
1.0
|
C
|
C:ILE153
|
4.5
|
42.5
|
1.0
|
CG
|
C:TYR154
|
4.6
|
68.2
|
1.0
|
C
|
C:ASN155
|
4.6
|
60.9
|
1.0
|
CB
|
C:TYR154
|
4.7
|
60.3
|
1.0
|
CA
|
C:SER222
|
4.7
|
53.1
|
1.0
|
CG2
|
C:ILE276
|
4.8
|
70.5
|
1.0
|
CD1
|
C:ILE276
|
4.8
|
66.9
|
1.0
|
CE1
|
C:TYR154
|
4.8
|
69.8
|
1.0
|
O
|
C:TYR154
|
4.8
|
54.0
|
1.0
|
O
|
C:ASN275
|
4.8
|
63.0
|
1.0
|
CB
|
C:ASN155
|
4.9
|
61.7
|
1.0
|
N
|
C:SER222
|
4.9
|
54.1
|
1.0
|
N
|
C:ASN277
|
5.0
|
61.2
|
1.0
|
|
Reference:
J.Ren,
Y.Zhang,
S.Wang,
L.Huo,
J.Lou,
W.Feng.
Structural Delineation of the Neck Linker of Kinesin-3 For Processive Movement. J. Mol. Biol. V. 430 2030 2018.
ISSN: ESSN 1089-8638
PubMed: 29752968
DOI: 10.1016/J.JMB.2018.05.010
Page generated: Mon Sep 30 11:48:28 2024
|