Zinc in PDB 6i5v: BLMNBP1 Binding Protein of An Abc Transporter From Bifidobacterium Animalis Subsp. Lactis ATCC27673 in Complex with Mannotriose
Protein crystallography data
The structure of BLMNBP1 Binding Protein of An Abc Transporter From Bifidobacterium Animalis Subsp. Lactis ATCC27673 in Complex with Mannotriose, PDB code: 6i5v
was solved by
M.Abou Hachem,
M.Ejby,
A.Guskov,
D.J.Slotboom,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
49.35 /
2.01
|
Space group
|
P 21 21 21
|
Cell size a, b, c (Å), α, β, γ (°)
|
56.330,
75.910,
102.310,
90.00,
90.00,
90.00
|
R / Rfree (%)
|
19.2 /
26.5
|
Zinc Binding Sites:
The binding sites of Zinc atom in the BLMNBP1 Binding Protein of An Abc Transporter From Bifidobacterium Animalis Subsp. Lactis ATCC27673 in Complex with Mannotriose
(pdb code 6i5v). This binding sites where shown within
5.0 Angstroms radius around Zinc atom.
In total 9 binding sites of Zinc where determined in the
BLMNBP1 Binding Protein of An Abc Transporter From Bifidobacterium Animalis Subsp. Lactis ATCC27673 in Complex with Mannotriose, PDB code: 6i5v:
Jump to Zinc binding site number:
1;
2;
3;
4;
5;
6;
7;
8;
9;
Zinc binding site 1 out
of 9 in 6i5v
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Zinc Binding Sites List in 6i5v
Zinc binding site 1 out
of 9 in the BLMNBP1 Binding Protein of An Abc Transporter From Bifidobacterium Animalis Subsp. Lactis ATCC27673 in Complex with Mannotriose
Mono view
Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 1 of BLMNBP1 Binding Protein of An Abc Transporter From Bifidobacterium Animalis Subsp. Lactis ATCC27673 in Complex with Mannotriose within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Zn504
b:34.6
occ:1.00
|
O
|
A:HOH736
|
1.9
|
35.0
|
1.0
|
O
|
A:HOH682
|
2.0
|
33.7
|
1.0
|
O
|
A:HOH810
|
2.0
|
30.1
|
1.0
|
OD1
|
A:ASP215
|
2.1
|
35.0
|
1.0
|
O
|
A:HOH857
|
2.2
|
34.0
|
1.0
|
CG
|
A:ASP215
|
2.9
|
34.2
|
1.0
|
OD2
|
A:ASP215
|
3.0
|
39.7
|
1.0
|
HE22
|
A:GLN430
|
3.1
|
43.0
|
1.0
|
HZ1
|
A:LYS427
|
3.2
|
52.2
|
1.0
|
NE2
|
A:GLN430
|
3.9
|
35.8
|
1.0
|
O
|
A:VAL213
|
4.1
|
27.7
|
1.0
|
NZ
|
A:LYS427
|
4.1
|
43.5
|
1.0
|
OE1
|
A:GLN430
|
4.2
|
40.8
|
1.0
|
H
|
A:ASP215
|
4.2
|
40.4
|
1.0
|
O
|
A:HOH918
|
4.3
|
38.8
|
1.0
|
CB
|
A:ASP215
|
4.3
|
34.9
|
1.0
|
HZ2
|
A:LYS427
|
4.3
|
52.2
|
1.0
|
HZ3
|
A:LYS427
|
4.4
|
52.2
|
1.0
|
O
|
A:HOH832
|
4.5
|
42.3
|
1.0
|
HE21
|
A:GLN430
|
4.5
|
43.0
|
1.0
|
CD
|
A:GLN430
|
4.5
|
37.3
|
1.0
|
HD3
|
A:LYS427
|
4.7
|
38.9
|
1.0
|
HA
|
A:ASP215
|
4.7
|
34.3
|
1.0
|
O
|
A:HOH606
|
4.7
|
44.8
|
1.0
|
HB2
|
A:ASP215
|
4.7
|
41.8
|
1.0
|
N
|
A:ASP215
|
4.7
|
33.6
|
1.0
|
CA
|
A:ASP215
|
4.9
|
28.6
|
1.0
|
HB3
|
A:ASP215
|
4.9
|
41.8
|
1.0
|
|
Zinc binding site 2 out
of 9 in 6i5v
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Zinc Binding Sites List in 6i5v
Zinc binding site 2 out
of 9 in the BLMNBP1 Binding Protein of An Abc Transporter From Bifidobacterium Animalis Subsp. Lactis ATCC27673 in Complex with Mannotriose
Mono view
Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 2 of BLMNBP1 Binding Protein of An Abc Transporter From Bifidobacterium Animalis Subsp. Lactis ATCC27673 in Complex with Mannotriose within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Zn505
b:43.1
occ:1.00
|
OE2
|
A:GLU449
|
2.1
|
41.0
|
1.0
|
O
|
A:HOH622
|
2.2
|
38.5
|
1.0
|
CD
|
A:GLU449
|
2.7
|
38.9
|
1.0
|
OE1
|
A:GLU449
|
2.7
|
36.9
|
1.0
|
HZ1
|
A:LYS453
|
3.4
|
58.6
|
1.0
|
HZ3
|
A:LYS453
|
3.5
|
58.6
|
1.0
|
HZ2
|
A:LYS453
|
3.6
|
58.6
|
1.0
|
NZ
|
A:LYS453
|
3.7
|
48.8
|
1.0
|
OD2
|
A:ASP431
|
3.8
|
43.4
|
1.0
|
O
|
A:HOH697
|
3.9
|
35.1
|
1.0
|
HH22
|
A:ARG441
|
4.0
|
46.3
|
1.0
|
CG
|
A:GLU449
|
4.1
|
33.9
|
1.0
|
HH12
|
A:ARG441
|
4.1
|
45.4
|
1.0
|
HG2
|
A:GLU449
|
4.2
|
40.7
|
1.0
|
HG3
|
A:GLU449
|
4.4
|
40.7
|
1.0
|
NH2
|
A:ARG441
|
4.6
|
38.6
|
1.0
|
NH1
|
A:ARG441
|
4.7
|
37.8
|
1.0
|
|
Zinc binding site 3 out
of 9 in 6i5v
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Zinc Binding Sites List in 6i5v
Zinc binding site 3 out
of 9 in the BLMNBP1 Binding Protein of An Abc Transporter From Bifidobacterium Animalis Subsp. Lactis ATCC27673 in Complex with Mannotriose
Mono view
Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 3 of BLMNBP1 Binding Protein of An Abc Transporter From Bifidobacterium Animalis Subsp. Lactis ATCC27673 in Complex with Mannotriose within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Zn506
b:0.6
occ:1.00
|
O
|
A:HOH916
|
2.4
|
66.7
|
1.0
|
O
|
A:HOH869
|
2.4
|
63.5
|
1.0
|
OD2
|
A:ASP416
|
3.1
|
40.2
|
1.0
|
O
|
A:HOH771
|
3.1
|
53.1
|
1.0
|
O
|
A:HOH928
|
3.2
|
53.9
|
1.0
|
OD1
|
A:ASN461
|
3.3
|
31.1
|
1.0
|
OD1
|
A:ASP416
|
3.6
|
38.2
|
1.0
|
HD21
|
A:ASN461
|
3.7
|
49.4
|
1.0
|
CG
|
A:ASP416
|
3.7
|
36.5
|
1.0
|
HB3
|
A:ASN412
|
3.9
|
47.6
|
1.0
|
CG
|
A:ASN461
|
4.1
|
35.5
|
1.0
|
ND2
|
A:ASN461
|
4.2
|
41.2
|
1.0
|
O
|
A:HOH899
|
4.6
|
48.7
|
1.0
|
CB
|
A:ASN412
|
4.8
|
39.6
|
1.0
|
O
|
A:HOH767
|
4.9
|
42.7
|
1.0
|
O
|
A:ASN412
|
4.9
|
35.1
|
1.0
|
|
Zinc binding site 4 out
of 9 in 6i5v
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Zinc Binding Sites List in 6i5v
Zinc binding site 4 out
of 9 in the BLMNBP1 Binding Protein of An Abc Transporter From Bifidobacterium Animalis Subsp. Lactis ATCC27673 in Complex with Mannotriose
Mono view
Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 4 of BLMNBP1 Binding Protein of An Abc Transporter From Bifidobacterium Animalis Subsp. Lactis ATCC27673 in Complex with Mannotriose within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Zn507
b:42.8
occ:1.00
|
O
|
A:HOH627
|
1.7
|
33.3
|
1.0
|
OD1
|
A:ASP435
|
2.2
|
39.8
|
1.0
|
OD2
|
A:ASP435
|
2.6
|
37.0
|
1.0
|
CG
|
A:ASP435
|
2.7
|
37.9
|
1.0
|
HD21
|
A:ASN438
|
3.7
|
53.9
|
1.0
|
HE
|
A:ARG441
|
3.8
|
43.7
|
1.0
|
HG12
|
A:VAL434
|
3.9
|
44.1
|
1.0
|
OG1
|
A:THR440
|
4.0
|
38.3
|
1.0
|
OD1
|
A:ASP431
|
4.1
|
41.3
|
1.0
|
HH21
|
A:ARG441
|
4.1
|
46.3
|
1.0
|
CB
|
A:ASP435
|
4.1
|
38.9
|
1.0
|
HG1
|
A:THR440
|
4.2
|
45.9
|
1.0
|
NE
|
A:ARG441
|
4.4
|
36.4
|
1.0
|
HA
|
A:ASP435
|
4.5
|
43.0
|
1.0
|
HB3
|
A:ASP435
|
4.5
|
46.7
|
1.0
|
ND2
|
A:ASN438
|
4.6
|
44.9
|
1.0
|
HG3
|
A:ARG441
|
4.6
|
46.7
|
1.0
|
HB2
|
A:ASP435
|
4.7
|
46.7
|
1.0
|
NH2
|
A:ARG441
|
4.7
|
38.6
|
1.0
|
CG1
|
A:VAL434
|
4.8
|
36.8
|
1.0
|
CA
|
A:ASP435
|
4.8
|
35.9
|
1.0
|
HG11
|
A:VAL434
|
4.8
|
44.1
|
1.0
|
CZ
|
A:ARG441
|
4.9
|
43.8
|
1.0
|
CG
|
A:ASP431
|
5.0
|
48.8
|
1.0
|
|
Zinc binding site 5 out
of 9 in 6i5v
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Zinc Binding Sites List in 6i5v
Zinc binding site 5 out
of 9 in the BLMNBP1 Binding Protein of An Abc Transporter From Bifidobacterium Animalis Subsp. Lactis ATCC27673 in Complex with Mannotriose
Mono view
Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 5 of BLMNBP1 Binding Protein of An Abc Transporter From Bifidobacterium Animalis Subsp. Lactis ATCC27673 in Complex with Mannotriose within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Zn508
b:84.2
occ:1.00
|
O
|
A:ASN461
|
2.1
|
36.5
|
1.0
|
O
|
A:HOH760
|
2.8
|
27.8
|
1.0
|
O
|
A:HOH669
|
3.0
|
38.8
|
1.0
|
C
|
A:ASN461
|
3.3
|
37.2
|
1.0
|
O
|
A:GLU459
|
3.5
|
39.6
|
1.0
|
O
|
A:VAL458
|
3.6
|
30.0
|
1.0
|
OXT
|
A:ASN461
|
3.8
|
36.4
|
1.0
|
HA
|
A:GLU459
|
3.8
|
58.6
|
1.0
|
O
|
A:HOH883
|
4.1
|
40.6
|
1.0
|
C
|
A:GLU459
|
4.2
|
47.2
|
1.0
|
O
|
A:HOH647
|
4.3
|
39.3
|
1.0
|
H
|
A:ASN461
|
4.4
|
39.2
|
1.0
|
CA
|
A:ASN461
|
4.4
|
40.0
|
1.0
|
N
|
A:ASN461
|
4.4
|
32.6
|
1.0
|
CA
|
A:GLU459
|
4.5
|
48.9
|
1.0
|
O
|
A:HOH797
|
4.5
|
52.8
|
1.0
|
C
|
A:VAL458
|
4.7
|
34.2
|
1.0
|
OE2
|
A:GLU459
|
4.8
|
98.9
|
1.0
|
OE1
|
A:GLU459
|
4.8
|
89.5
|
1.0
|
HA
|
A:ASN461
|
4.9
|
48.0
|
1.0
|
O
|
A:HOH783
|
4.9
|
36.2
|
1.0
|
CD
|
A:GLU459
|
5.0
|
85.3
|
1.0
|
C
|
A:ASP460
|
5.0
|
37.8
|
1.0
|
|
Zinc binding site 6 out
of 9 in 6i5v
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Zinc Binding Sites List in 6i5v
Zinc binding site 6 out
of 9 in the BLMNBP1 Binding Protein of An Abc Transporter From Bifidobacterium Animalis Subsp. Lactis ATCC27673 in Complex with Mannotriose
Mono view
Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 6 of BLMNBP1 Binding Protein of An Abc Transporter From Bifidobacterium Animalis Subsp. Lactis ATCC27673 in Complex with Mannotriose within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Zn509
b:79.8
occ:1.00
|
OD2
|
A:ASP103
|
2.3
|
56.1
|
1.0
|
HZ3
|
A:LYS427
|
2.7
|
52.2
|
1.0
|
O
|
A:HOH606
|
2.8
|
44.8
|
1.0
|
CG
|
A:ASP103
|
3.3
|
57.0
|
1.0
|
HZ2
|
A:LYS427
|
3.4
|
52.2
|
1.0
|
NZ
|
A:LYS427
|
3.4
|
43.5
|
1.0
|
OD2
|
A:ASP215
|
3.6
|
39.7
|
1.0
|
OD1
|
A:ASP103
|
3.6
|
58.2
|
1.0
|
HZ1
|
A:LYS427
|
3.6
|
52.2
|
1.0
|
O
|
A:HOH857
|
4.0
|
34.0
|
1.0
|
CB
|
A:ASP103
|
4.5
|
46.1
|
1.0
|
OD1
|
A:ASN100
|
4.6
|
48.5
|
1.0
|
HB2
|
A:ASP103
|
4.6
|
55.4
|
1.0
|
CE
|
A:LYS427
|
4.6
|
46.3
|
1.0
|
HE2
|
A:LYS427
|
4.7
|
55.5
|
1.0
|
HB3
|
A:ASP103
|
4.7
|
55.4
|
1.0
|
CG
|
A:ASP215
|
4.8
|
34.2
|
1.0
|
HE3
|
A:LYS427
|
4.9
|
55.5
|
1.0
|
|
Zinc binding site 7 out
of 9 in 6i5v
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Zinc Binding Sites List in 6i5v
Zinc binding site 7 out
of 9 in the BLMNBP1 Binding Protein of An Abc Transporter From Bifidobacterium Animalis Subsp. Lactis ATCC27673 in Complex with Mannotriose
Mono view
Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 7 of BLMNBP1 Binding Protein of An Abc Transporter From Bifidobacterium Animalis Subsp. Lactis ATCC27673 in Complex with Mannotriose within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Zn510
b:87.5
occ:1.00
|
HG
|
A:SER252
|
1.9
|
73.2
|
1.0
|
OD1
|
A:ASP250
|
2.5
|
49.9
|
1.0
|
OG
|
A:SER252
|
2.5
|
61.0
|
1.0
|
O
|
A:HOH895
|
2.9
|
72.4
|
1.0
|
H
|
A:SER252
|
3.2
|
47.9
|
1.0
|
CG
|
A:ASP250
|
3.2
|
42.4
|
1.0
|
OD2
|
A:ASP250
|
3.4
|
45.6
|
1.0
|
HB3
|
A:SER252
|
3.5
|
69.8
|
1.0
|
CB
|
A:SER252
|
3.6
|
58.2
|
1.0
|
N
|
A:SER252
|
4.0
|
39.9
|
1.0
|
H
|
A:ALA253
|
4.1
|
54.0
|
1.0
|
O
|
A:HOH861
|
4.1
|
61.4
|
1.0
|
H
|
A:ALA251
|
4.2
|
45.8
|
1.0
|
HB2
|
A:SER252
|
4.3
|
69.8
|
1.0
|
CA
|
A:SER252
|
4.3
|
49.1
|
1.0
|
HA
|
A:ASP250
|
4.6
|
42.7
|
1.0
|
CB
|
A:ASP250
|
4.6
|
38.2
|
1.0
|
N
|
A:ALA253
|
4.6
|
45.0
|
1.0
|
N
|
A:ALA251
|
4.6
|
38.2
|
1.0
|
O
|
A:HOH800
|
4.7
|
41.7
|
1.0
|
HB3
|
A:ALA253
|
4.8
|
49.1
|
1.0
|
C
|
A:SER252
|
4.9
|
52.2
|
1.0
|
C
|
A:ASP250
|
4.9
|
40.3
|
1.0
|
CA
|
A:ASP250
|
4.9
|
35.6
|
1.0
|
HB2
|
A:ASP250
|
5.0
|
45.9
|
1.0
|
|
Zinc binding site 8 out
of 9 in 6i5v
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Zinc Binding Sites List in 6i5v
Zinc binding site 8 out
of 9 in the BLMNBP1 Binding Protein of An Abc Transporter From Bifidobacterium Animalis Subsp. Lactis ATCC27673 in Complex with Mannotriose
Mono view
Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 8 of BLMNBP1 Binding Protein of An Abc Transporter From Bifidobacterium Animalis Subsp. Lactis ATCC27673 in Complex with Mannotriose within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Zn511
b:80.5
occ:1.00
|
OD2
|
A:ASP328
|
2.3
|
74.4
|
1.0
|
CG
|
A:ASP328
|
3.3
|
67.0
|
1.0
|
OD1
|
A:ASP328
|
3.6
|
70.3
|
1.0
|
HZ1
|
A:LYS330
|
3.8
|
88.4
|
1.0
|
O
|
A:HOH631
|
4.1
|
57.9
|
1.0
|
HZ2
|
A:LYS330
|
4.4
|
88.4
|
1.0
|
NZ
|
A:LYS330
|
4.4
|
73.7
|
1.0
|
HZ3
|
A:LYS330
|
4.5
|
88.4
|
1.0
|
CB
|
A:ASP328
|
4.6
|
54.6
|
1.0
|
HB3
|
A:ASP328
|
4.6
|
65.5
|
1.0
|
HB2
|
A:ASP328
|
5.0
|
65.5
|
1.0
|
|
Zinc binding site 9 out
of 9 in 6i5v
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Zinc Binding Sites List in 6i5v
Zinc binding site 9 out
of 9 in the BLMNBP1 Binding Protein of An Abc Transporter From Bifidobacterium Animalis Subsp. Lactis ATCC27673 in Complex with Mannotriose
Mono view
Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 9 of BLMNBP1 Binding Protein of An Abc Transporter From Bifidobacterium Animalis Subsp. Lactis ATCC27673 in Complex with Mannotriose within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Zn512
b:89.5
occ:1.00
|
OE1
|
A:GLU459
|
1.9
|
89.5
|
1.0
|
CD
|
A:GLU459
|
2.7
|
85.3
|
1.0
|
O
|
A:HOH669
|
2.9
|
38.8
|
1.0
|
OE2
|
A:GLU459
|
3.1
|
98.9
|
1.0
|
HZ1
|
A:LYS244
|
3.2
|
77.3
|
1.0
|
NZ
|
A:LYS244
|
4.0
|
64.4
|
1.0
|
CG
|
A:GLU459
|
4.1
|
66.2
|
1.0
|
HG2
|
A:GLU459
|
4.1
|
79.5
|
1.0
|
HA
|
A:GLU459
|
4.3
|
58.6
|
1.0
|
HZ2
|
A:LYS244
|
4.4
|
77.3
|
1.0
|
HZ3
|
A:LYS244
|
4.4
|
77.3
|
1.0
|
HB2
|
A:GLU459
|
4.5
|
59.3
|
1.0
|
HE3
|
A:LYS244
|
4.5
|
73.2
|
1.0
|
HE2
|
A:LYS244
|
4.6
|
73.2
|
1.0
|
CE
|
A:LYS244
|
4.7
|
61.0
|
1.0
|
HG3
|
A:GLU459
|
4.7
|
79.5
|
1.0
|
CB
|
A:GLU459
|
4.8
|
49.4
|
1.0
|
|
Reference:
M.Ejby,
A.Guskov,
M.J.Pichler,
G.C.Zanten,
E.Schoof,
W.Saburi,
D.J.Slotboom,
M.Abou Hachem.
Two Binding Proteins of the Abc Transporter That Confers Growth of Bifidobacterium Animalis Subsp. Lactis ATCC27673 on Beta-Mannan Possess Distinct Manno-Oligosaccharide-Binding Profiles. Mol.Microbiol. V. 112 114 2019.
ISSN: ESSN 1365-2958
PubMed: 30947380
DOI: 10.1111/MMI.14257
Page generated: Mon Oct 28 23:35:32 2024
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