Magnesium in PDB 6a1z: Crystal Structure of Dimeric Kinesin-3 KIF13B
Protein crystallography data
The structure of Crystal Structure of Dimeric Kinesin-3 KIF13B, PDB code: 6a1z
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)
|
39.87 /
2.58
|
Space group
|
P 32 2 1
|
Cell size a, b, c (Å), α, β, γ (°)
|
87.380,
87.380,
97.490,
90.00,
90.00,
120.00
|
R / Rfree (%)
|
23.8 /
28.6
|
Magnesium Binding Sites:
The binding sites of Magnesium atom in the Crystal Structure of Dimeric Kinesin-3 KIF13B
(pdb code 6a1z). This binding sites where shown within
5.0 Angstroms radius around Magnesium atom.
In total 3 binding sites of Magnesium where determined in the
Crystal Structure of Dimeric Kinesin-3 KIF13B, PDB code: 6a1z:
Jump to Magnesium binding site number:
1;
2;
3;
Magnesium binding site 1 out
of 3 in 6a1z
Go back to
Magnesium Binding Sites List in 6a1z
Magnesium binding site 1 out
of 3 in the Crystal Structure of Dimeric Kinesin-3 KIF13B
 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 Dimeric Kinesin-3 KIF13B within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Mg402
b:54.4
occ:1.00
|
O
|
A:HOH523
|
1.8
|
57.4
|
1.0
|
O1B
|
A:ADP401
|
2.3
|
46.0
|
1.0
|
OG
|
A:SER110
|
2.8
|
50.6
|
1.0
|
PB
|
A:ADP401
|
3.6
|
47.6
|
1.0
|
CB
|
A:SER110
|
3.6
|
42.8
|
1.0
|
OD2
|
A:ASP253
|
3.9
|
60.2
|
1.0
|
N
|
A:SER110
|
3.9
|
48.5
|
1.0
|
O
|
A:HOH514
|
4.0
|
57.4
|
1.0
|
OD1
|
A:ASP253
|
4.1
|
60.1
|
1.0
|
O3B
|
A:ADP401
|
4.2
|
62.4
|
1.0
|
CA
|
A:SER110
|
4.2
|
45.6
|
1.0
|
CG
|
A:ASP253
|
4.4
|
61.0
|
1.0
|
O2B
|
A:ADP401
|
4.4
|
55.8
|
1.0
|
O2A
|
A:ADP401
|
4.5
|
62.8
|
1.0
|
CB
|
A:LYS109
|
4.5
|
45.6
|
1.0
|
O3A
|
A:ADP401
|
4.7
|
51.1
|
1.0
|
C
|
A:LYS109
|
4.7
|
49.0
|
1.0
|
O
|
A:LEU254
|
4.9
|
53.5
|
1.0
|
NH1
|
A:ARG208
|
4.9
|
66.5
|
1.0
|
NZ
|
A:LYS109
|
5.0
|
45.3
|
1.0
|
CE
|
A:LYS109
|
5.0
|
47.8
|
1.0
|
|
Magnesium binding site 2 out
of 3 in 6a1z
Go back to
Magnesium Binding Sites List in 6a1z
Magnesium binding site 2 out
of 3 in the Crystal Structure of Dimeric Kinesin-3 KIF13B
 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 Dimeric Kinesin-3 KIF13B within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Mg403
b:53.7
occ:1.00
|
O
|
A:THR329
|
2.7
|
48.8
|
1.0
|
OG1
|
A:THR343
|
2.9
|
52.0
|
1.0
|
O
|
A:HOH507
|
3.1
|
51.7
|
1.0
|
CB
|
A:THR343
|
3.2
|
50.7
|
1.0
|
CG2
|
A:THR343
|
3.4
|
42.1
|
1.0
|
N
|
A:GLN104
|
3.5
|
50.8
|
1.0
|
CA
|
A:VAL330
|
3.5
|
49.4
|
1.0
|
C
|
A:THR329
|
3.7
|
45.5
|
1.0
|
CG1
|
A:VAL330
|
3.7
|
51.2
|
1.0
|
CG
|
A:GLN104
|
3.8
|
47.1
|
1.0
|
CA
|
A:GLY103
|
3.8
|
45.9
|
1.0
|
CB
|
A:VAL330
|
4.0
|
46.0
|
1.0
|
CB
|
A:SER107
|
4.1
|
50.5
|
1.0
|
N
|
A:VAL330
|
4.1
|
44.6
|
1.0
|
O
|
A:GLU339
|
4.1
|
47.6
|
1.0
|
OG
|
A:SER107
|
4.2
|
50.5
|
1.0
|
C
|
A:GLY103
|
4.2
|
44.5
|
1.0
|
CB
|
A:GLN104
|
4.2
|
50.5
|
1.0
|
OE1
|
A:GLN104
|
4.3
|
52.0
|
1.0
|
CA
|
A:GLN104
|
4.5
|
51.0
|
1.0
|
CA
|
A:THR340
|
4.5
|
50.1
|
1.0
|
CD
|
A:GLN104
|
4.5
|
50.7
|
1.0
|
N
|
A:SER331
|
4.6
|
54.2
|
1.0
|
C
|
A:GLU339
|
4.6
|
47.9
|
1.0
|
C
|
A:VAL330
|
4.6
|
52.4
|
1.0
|
CA
|
A:THR343
|
4.7
|
51.9
|
1.0
|
N
|
A:THR340
|
4.8
|
45.2
|
1.0
|
OG1
|
A:THR340
|
4.9
|
44.7
|
1.0
|
OG
|
A:SER257
|
5.0
|
52.9
|
1.0
|
|
Magnesium binding site 3 out
of 3 in 6a1z
Go back to
Magnesium Binding Sites List in 6a1z
Magnesium binding site 3 out
of 3 in the Crystal Structure of Dimeric Kinesin-3 KIF13B
 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 Dimeric Kinesin-3 KIF13B within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Mg404
b:54.3
occ:1.00
|
OG
|
A:SER250
|
2.7
|
44.2
|
1.0
|
O
|
A:ALA97
|
2.8
|
48.5
|
1.0
|
O
|
A:LYS248
|
3.2
|
49.4
|
1.0
|
CB
|
A:SER250
|
3.4
|
45.9
|
1.0
|
N
|
A:SER250
|
3.5
|
51.0
|
1.0
|
C
|
A:LYS248
|
3.8
|
50.3
|
1.0
|
OG
|
A:SER317
|
3.8
|
52.9
|
1.0
|
C
|
A:ALA97
|
3.9
|
48.9
|
1.0
|
C
|
A:LEU249
|
4.0
|
50.7
|
1.0
|
CA
|
A:SER250
|
4.1
|
47.5
|
1.0
|
CB
|
A:LYS248
|
4.1
|
53.3
|
1.0
|
N
|
A:ALA97
|
4.1
|
48.9
|
1.0
|
CA
|
A:LEU249
|
4.2
|
54.0
|
1.0
|
OG
|
A:SER322
|
4.2
|
46.0
|
1.0
|
N
|
A:LEU249
|
4.3
|
50.5
|
1.0
|
CB
|
A:ASN96
|
4.3
|
48.7
|
1.0
|
CB
|
A:CYS98
|
4.3
|
48.4
|
1.0
|
CA
|
A:LYS248
|
4.6
|
53.5
|
1.0
|
CA
|
A:ALA97
|
4.6
|
45.2
|
1.0
|
C
|
A:ASN96
|
4.7
|
50.2
|
1.0
|
CA
|
A:ASN96
|
4.7
|
50.1
|
1.0
|
N
|
A:CYS98
|
4.7
|
46.8
|
1.0
|
CA
|
A:CYS98
|
4.8
|
47.3
|
1.0
|
O
|
A:LEU249
|
4.8
|
47.0
|
1.0
|
CG
|
A:ASN96
|
4.8
|
48.1
|
1.0
|
OD1
|
A:ASN96
|
4.9
|
49.1
|
1.0
|
|
Reference:
J.Q.Ren,
S.Wang,
H.Chen,
W.J.Wang,
L.Huo,
W.Feng.
Coiled-Coil 1-Mediated Fastening of the Neck and Motor Domains For Kinesin-3 Autoinhibition. Proc. Natl. Acad. Sci. V. 115 11933 2018U.S.A..
ISSN: ESSN 1091-6490
PubMed: 30463954
DOI: 10.1073/PNAS.1811209115
Page generated: Mon Sep 30 18:55:51 2024
|