Zinc in PDB 6i5w: BLMNBP1 Binding Protein of An Abc Transporter From Bifidobacterium Animalis Subsp. Lactis ATCC27673 in Complex with Mannobiose
Protein crystallography data
The structure of BLMNBP1 Binding Protein of An Abc Transporter From Bifidobacterium Animalis Subsp. Lactis ATCC27673 in Complex with Mannobiose, PDB code: 6i5w
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)
|
47.55 /
1.90
|
Space group
|
P 21 21 21
|
Cell size a, b, c (Å), α, β, γ (°)
|
53.520,
73.250,
103.610,
90.00,
90.00,
90.00
|
R / Rfree (%)
|
21 /
27.3
|
Zinc Binding Sites:
Pages:
>>> Page 1 <<<
Page 2, Binding sites: 11 -
17;
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 Mannobiose
(pdb code 6i5w). This binding sites where shown within
5.0 Angstroms radius around Zinc atom.
In total 17 binding sites of Zinc where determined in the
BLMNBP1 Binding Protein of An Abc Transporter From Bifidobacterium Animalis Subsp. Lactis ATCC27673 in Complex with Mannobiose, PDB code: 6i5w:
Jump to Zinc binding site number:
1;
2;
3;
4;
5;
6;
7;
8;
9;
10;
Zinc binding site 1 out
of 17 in 6i5w
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Zinc Binding Sites List in 6i5w
Zinc binding site 1 out
of 17 in the BLMNBP1 Binding Protein of An Abc Transporter From Bifidobacterium Animalis Subsp. Lactis ATCC27673 in Complex with Mannobiose
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 Mannobiose within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Zn713
b:79.4
occ:1.00
|
OD1
|
A:ASP155
|
2.2
|
58.0
|
1.0
|
ZN
|
A:ZN717
|
3.1
|
44.2
|
1.0
|
CG
|
A:ASP155
|
3.3
|
56.2
|
1.0
|
ZN
|
A:ZN722
|
3.4
|
79.1
|
1.0
|
OH
|
A:TYR154
|
3.5
|
57.7
|
1.0
|
CZ
|
A:TYR154
|
3.6
|
63.1
|
1.0
|
OE2
|
A:GLU407
|
3.7
|
72.0
|
1.0
|
CE2
|
A:TYR154
|
3.9
|
58.6
|
1.0
|
OD2
|
A:ASP155
|
3.9
|
56.1
|
1.0
|
HE2
|
A:TYR154
|
3.9
|
70.3
|
1.0
|
HA
|
A:ASP155
|
4.0
|
68.8
|
1.0
|
H
|
A:ASP155
|
4.1
|
73.9
|
1.0
|
HH
|
A:TYR154
|
4.2
|
69.3
|
1.0
|
CD
|
A:GLU407
|
4.3
|
51.8
|
1.0
|
CE1
|
A:TYR154
|
4.3
|
60.3
|
1.0
|
OE1
|
A:GLU407
|
4.4
|
50.6
|
1.0
|
O
|
A:HOH802
|
4.4
|
57.2
|
1.0
|
OE2
|
A:GLU404
|
4.4
|
64.9
|
1.0
|
O
|
A:HOH807
|
4.5
|
46.1
|
1.0
|
CB
|
A:ASP155
|
4.5
|
56.4
|
1.0
|
HE1
|
A:TYR154
|
4.5
|
72.4
|
1.0
|
CA
|
A:ASP155
|
4.6
|
57.3
|
1.0
|
CD2
|
A:TYR154
|
4.7
|
49.5
|
1.0
|
N
|
A:ASP155
|
4.7
|
61.6
|
1.0
|
HA2
|
A:GLY405
|
4.8
|
48.3
|
1.0
|
HB2
|
A:GLU407
|
4.8
|
56.0
|
1.0
|
H
|
A:GLY405
|
4.9
|
46.9
|
1.0
|
HB3
|
A:ASP155
|
5.0
|
67.8
|
1.0
|
|
Zinc binding site 2 out
of 17 in 6i5w
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Zinc Binding Sites List in 6i5w
Zinc binding site 2 out
of 17 in the BLMNBP1 Binding Protein of An Abc Transporter From Bifidobacterium Animalis Subsp. Lactis ATCC27673 in Complex with Mannobiose
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 Mannobiose within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Zn714
b:91.0
occ:1.00
|
OD1
|
A:ASP215
|
2.1
|
68.1
|
1.0
|
OD2
|
A:ASP215
|
2.2
|
66.2
|
1.0
|
O
|
A:HOH827
|
2.4
|
45.9
|
1.0
|
CG
|
A:ASP215
|
2.4
|
62.4
|
1.0
|
O
|
A:HOH896
|
2.5
|
42.3
|
1.0
|
HZ1
|
A:LYS427
|
2.5
|
59.4
|
1.0
|
HZ3
|
A:LYS427
|
2.7
|
59.4
|
1.0
|
NZ
|
A:LYS427
|
3.0
|
49.5
|
1.0
|
HE22
|
A:GLN430
|
3.1
|
52.8
|
1.0
|
HZ2
|
A:LYS427
|
3.4
|
59.4
|
1.0
|
O
|
A:VAL213
|
3.7
|
40.4
|
1.0
|
NE2
|
A:GLN430
|
3.9
|
43.9
|
1.0
|
H
|
A:ASP215
|
3.9
|
52.9
|
1.0
|
CB
|
A:ASP215
|
4.0
|
38.2
|
1.0
|
HE2
|
A:LYS427
|
4.2
|
59.7
|
1.0
|
HE21
|
A:GLN430
|
4.2
|
52.8
|
1.0
|
CE
|
A:LYS427
|
4.2
|
49.7
|
1.0
|
HB3
|
A:ASP215
|
4.4
|
45.9
|
1.0
|
HB2
|
A:ASP215
|
4.4
|
45.9
|
1.0
|
N
|
A:ASP215
|
4.5
|
44.1
|
1.0
|
CA
|
A:ASP215
|
4.7
|
36.6
|
1.0
|
HE3
|
A:LYS427
|
4.7
|
59.7
|
1.0
|
HA
|
A:ASP215
|
4.8
|
43.9
|
1.0
|
C
|
A:VAL213
|
4.8
|
37.2
|
1.0
|
CD
|
A:GLN430
|
4.9
|
42.5
|
1.0
|
HD3
|
A:LYS427
|
4.9
|
47.9
|
1.0
|
|
Zinc binding site 3 out
of 17 in 6i5w
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Zinc Binding Sites List in 6i5w
Zinc binding site 3 out
of 17 in the BLMNBP1 Binding Protein of An Abc Transporter From Bifidobacterium Animalis Subsp. Lactis ATCC27673 in Complex with Mannobiose
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 Mannobiose within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Zn715
b:73.2
occ:1.00
|
OD2
|
A:ASP313
|
2.0
|
72.7
|
1.0
|
OD1
|
A:ASP313
|
2.2
|
75.2
|
1.0
|
CG
|
A:ASP313
|
2.4
|
64.8
|
1.0
|
O
|
A:HOH811
|
4.0
|
46.4
|
1.0
|
CB
|
A:ASP313
|
4.0
|
52.8
|
1.0
|
HB3
|
A:ASP313
|
4.3
|
63.4
|
1.0
|
HB2
|
A:ASP313
|
4.4
|
63.4
|
1.0
|
HA
|
A:ASP313
|
4.5
|
53.3
|
1.0
|
CA
|
A:ASP313
|
4.8
|
44.4
|
1.0
|
|
Zinc binding site 4 out
of 17 in 6i5w
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Zinc Binding Sites List in 6i5w
Zinc binding site 4 out
of 17 in the BLMNBP1 Binding Protein of An Abc Transporter From Bifidobacterium Animalis Subsp. Lactis ATCC27673 in Complex with Mannobiose
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 Mannobiose within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Zn716
b:0.5
occ:1.00
|
OD1
|
A:ASP328
|
2.0
|
0.6
|
1.0
|
CG
|
A:ASP328
|
3.2
|
0.8
|
1.0
|
HA
|
A:ASP328
|
3.4
|
69.1
|
1.0
|
OD2
|
A:ASP328
|
4.1
|
0.6
|
1.0
|
CB
|
A:ASP328
|
4.1
|
81.1
|
1.0
|
HB2
|
A:ASP328
|
4.1
|
97.4
|
1.0
|
CA
|
A:ASP328
|
4.2
|
57.5
|
1.0
|
HB3
|
A:ASP328
|
4.9
|
97.4
|
1.0
|
|
Zinc binding site 5 out
of 17 in 6i5w
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Zinc Binding Sites List in 6i5w
Zinc binding site 5 out
of 17 in the BLMNBP1 Binding Protein of An Abc Transporter From Bifidobacterium Animalis Subsp. Lactis ATCC27673 in Complex with Mannobiose
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 Mannobiose within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Zn717
b:44.2
occ:1.00
|
O
|
A:HOH807
|
2.5
|
46.1
|
1.0
|
ZN
|
A:ZN713
|
3.1
|
79.4
|
1.0
|
OD1
|
A:ASP155
|
3.7
|
58.0
|
1.0
|
OD2
|
A:ASP155
|
3.8
|
56.1
|
1.0
|
HE2
|
A:TYR154
|
3.8
|
70.3
|
1.0
|
OH
|
A:TYR154
|
3.9
|
57.7
|
1.0
|
CG
|
A:ASP155
|
4.2
|
56.2
|
1.0
|
CE2
|
A:TYR154
|
4.4
|
58.6
|
1.0
|
HH
|
A:TYR154
|
4.5
|
69.3
|
1.0
|
CZ
|
A:TYR154
|
4.6
|
63.1
|
1.0
|
|
Zinc binding site 6 out
of 17 in 6i5w
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Zinc Binding Sites List in 6i5w
Zinc binding site 6 out
of 17 in the BLMNBP1 Binding Protein of An Abc Transporter From Bifidobacterium Animalis Subsp. Lactis ATCC27673 in Complex with Mannobiose
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 Mannobiose within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Zn718
b:57.4
occ:1.00
|
OD2
|
A:ASP250
|
1.9
|
38.3
|
1.0
|
O
|
A:HOH893
|
2.5
|
57.0
|
1.0
|
O
|
A:HOH903
|
2.6
|
52.6
|
1.0
|
CG
|
A:ASP250
|
2.7
|
29.8
|
1.0
|
OD1
|
A:ASP250
|
2.9
|
38.1
|
1.0
|
HE1
|
A:HIS257
|
3.4
|
36.4
|
1.0
|
HB2
|
A:SER252
|
3.5
|
69.2
|
1.0
|
ZN
|
A:ZN719
|
3.6
|
44.4
|
1.0
|
CE1
|
A:HIS257
|
3.7
|
30.3
|
1.0
|
NE2
|
A:HIS257
|
3.9
|
29.6
|
1.0
|
CB
|
A:ASP250
|
4.2
|
29.0
|
1.0
|
HB2
|
A:ASP250
|
4.3
|
34.9
|
1.0
|
H
|
A:ALA253
|
4.4
|
45.0
|
1.0
|
CB
|
A:SER252
|
4.5
|
57.7
|
1.0
|
ND1
|
A:HIS257
|
4.5
|
27.6
|
1.0
|
HG
|
A:SER252
|
4.5
|
89.6
|
1.0
|
H
|
A:SER252
|
4.6
|
39.4
|
1.0
|
HB3
|
A:ALA253
|
4.7
|
44.1
|
1.0
|
HB3
|
A:ASP250
|
4.7
|
34.9
|
1.0
|
OG
|
A:SER252
|
4.8
|
74.6
|
1.0
|
CD2
|
A:HIS257
|
4.8
|
29.1
|
1.0
|
HD1
|
A:HIS257
|
4.8
|
33.2
|
1.0
|
HA
|
A:ASP250
|
4.8
|
39.2
|
1.0
|
HB3
|
A:SER252
|
4.9
|
69.2
|
1.0
|
|
Zinc binding site 7 out
of 17 in 6i5w
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Zinc Binding Sites List in 6i5w
Zinc binding site 7 out
of 17 in the BLMNBP1 Binding Protein of An Abc Transporter From Bifidobacterium Animalis Subsp. Lactis ATCC27673 in Complex with Mannobiose
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 Mannobiose within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Zn719
b:44.4
occ:1.00
|
NE2
|
A:HIS257
|
2.0
|
29.6
|
1.0
|
O
|
A:HOH897
|
2.2
|
41.5
|
1.0
|
O
|
A:HOH901
|
2.6
|
47.5
|
1.0
|
CE1
|
A:HIS257
|
2.8
|
30.3
|
1.0
|
HE1
|
A:HIS257
|
2.9
|
36.4
|
1.0
|
CD2
|
A:HIS257
|
3.1
|
29.1
|
1.0
|
HD2
|
A:HIS257
|
3.4
|
35.0
|
1.0
|
ZN
|
A:ZN718
|
3.6
|
57.4
|
1.0
|
ND1
|
A:HIS257
|
4.0
|
27.6
|
1.0
|
OD2
|
A:ASP250
|
4.1
|
38.3
|
1.0
|
CG
|
A:HIS257
|
4.2
|
25.0
|
1.0
|
HE1
|
A:PHE235
|
4.4
|
38.7
|
1.0
|
O
|
A:HOH903
|
4.6
|
52.6
|
1.0
|
O
|
A:HOH842
|
4.7
|
40.9
|
1.0
|
HD1
|
A:HIS257
|
4.7
|
33.2
|
1.0
|
HB
|
A:THR230
|
4.9
|
32.2
|
1.0
|
HG11
|
A:VAL239
|
5.0
|
45.8
|
1.0
|
|
Zinc binding site 8 out
of 17 in 6i5w
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Zinc Binding Sites List in 6i5w
Zinc binding site 8 out
of 17 in the BLMNBP1 Binding Protein of An Abc Transporter From Bifidobacterium Animalis Subsp. Lactis ATCC27673 in Complex with Mannobiose
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 Mannobiose within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Zn720
b:93.3
occ:1.00
|
OE1
|
A:GLU49
|
2.0
|
79.9
|
1.0
|
OE2
|
A:GLU49
|
2.1
|
85.4
|
1.0
|
HZ1
|
A:LYS52
|
2.1
|
0.3
|
1.0
|
CD
|
A:GLU49
|
2.3
|
71.7
|
1.0
|
HZ2
|
A:LYS52
|
2.5
|
0.3
|
1.0
|
NZ
|
A:LYS52
|
2.7
|
87.7
|
1.0
|
HZ3
|
A:LYS52
|
3.0
|
0.3
|
1.0
|
CG
|
A:GLU49
|
3.8
|
66.4
|
1.0
|
HD2
|
A:LYS52
|
3.9
|
84.5
|
1.0
|
CE
|
A:LYS52
|
4.0
|
83.7
|
1.0
|
HD3
|
A:LYS52
|
4.0
|
84.5
|
1.0
|
HG3
|
A:GLU49
|
4.1
|
79.7
|
1.0
|
CD
|
A:LYS52
|
4.2
|
70.4
|
1.0
|
HG2
|
A:GLU49
|
4.3
|
79.7
|
1.0
|
HB2
|
A:GLU49
|
4.4
|
65.2
|
1.0
|
HE3
|
A:LYS52
|
4.5
|
0.5
|
1.0
|
HE2
|
A:LYS52
|
4.5
|
0.5
|
1.0
|
CB
|
A:GLU49
|
4.7
|
54.3
|
1.0
|
|
Zinc binding site 9 out
of 17 in 6i5w
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Zinc Binding Sites List in 6i5w
Zinc binding site 9 out
of 17 in the BLMNBP1 Binding Protein of An Abc Transporter From Bifidobacterium Animalis Subsp. Lactis ATCC27673 in Complex with Mannobiose
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 Mannobiose within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Zn721
b:66.6
occ:1.00
|
OD1
|
A:ASP195
|
2.2
|
39.5
|
1.0
|
CG
|
A:ASP195
|
2.9
|
32.5
|
1.0
|
OD2
|
A:ASP195
|
3.0
|
33.2
|
1.0
|
HG23
|
A:ILE182
|
3.4
|
40.4
|
1.0
|
O
|
A:GLU184
|
3.9
|
41.2
|
1.0
|
HB3
|
A:GLU191
|
4.1
|
35.5
|
1.0
|
HB3
|
A:PRO186
|
4.3
|
36.7
|
1.0
|
CG2
|
A:ILE182
|
4.3
|
33.6
|
1.0
|
O
|
A:GLU191
|
4.3
|
27.0
|
1.0
|
CB
|
A:ASP195
|
4.4
|
18.8
|
1.0
|
HA
|
A:PRO186
|
4.4
|
32.4
|
1.0
|
HG21
|
A:ILE182
|
4.5
|
40.4
|
1.0
|
HA
|
A:ASP195
|
4.6
|
37.0
|
1.0
|
HG22
|
A:ILE182
|
4.6
|
40.4
|
1.0
|
H
|
A:GLU184
|
4.6
|
57.5
|
1.0
|
HB2
|
A:GLU184
|
4.7
|
60.7
|
1.0
|
HB2
|
A:ASP195
|
4.8
|
22.6
|
1.0
|
HG2
|
A:GLU191
|
4.8
|
47.0
|
1.0
|
HA
|
A:GLU191
|
4.8
|
34.9
|
1.0
|
HG12
|
A:ILE182
|
4.9
|
55.5
|
1.0
|
HA
|
A:ILE182
|
4.9
|
51.7
|
1.0
|
H
|
A:ASP195
|
4.9
|
39.1
|
1.0
|
CA
|
A:ASP195
|
4.9
|
30.8
|
1.0
|
HB3
|
A:ASP195
|
4.9
|
22.6
|
1.0
|
HB3
|
A:ALA194
|
4.9
|
28.1
|
1.0
|
CB
|
A:GLU191
|
4.9
|
29.5
|
1.0
|
N
|
A:ASP195
|
5.0
|
32.5
|
1.0
|
H
|
A:LYS183
|
5.0
|
61.4
|
1.0
|
|
Zinc binding site 10 out
of 17 in 6i5w
Go back to
Zinc Binding Sites List in 6i5w
Zinc binding site 10 out
of 17 in the BLMNBP1 Binding Protein of An Abc Transporter From Bifidobacterium Animalis Subsp. Lactis ATCC27673 in Complex with Mannobiose
Mono view
Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 10 of BLMNBP1 Binding Protein of An Abc Transporter From Bifidobacterium Animalis Subsp. Lactis ATCC27673 in Complex with Mannobiose within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Zn722
b:79.1
occ:1.00
|
OE2
|
A:GLU404
|
2.0
|
64.9
|
1.0
|
OE2
|
A:GLU407
|
2.1
|
72.0
|
1.0
|
OE1
|
A:GLU404
|
2.2
|
46.0
|
1.0
|
CD
|
A:GLU404
|
2.3
|
46.9
|
1.0
|
H
|
A:GLY405
|
2.9
|
46.9
|
1.0
|
CD
|
A:GLU407
|
3.0
|
51.8
|
1.0
|
OE1
|
A:GLU407
|
3.2
|
50.6
|
1.0
|
ZN
|
A:ZN713
|
3.4
|
79.4
|
1.0
|
HA
|
A:GLU404
|
3.6
|
44.2
|
1.0
|
O
|
A:HOH802
|
3.7
|
57.2
|
1.0
|
N
|
A:GLY405
|
3.7
|
39.0
|
1.0
|
CG
|
A:GLU404
|
3.8
|
50.6
|
1.0
|
HG3
|
A:GLU404
|
4.2
|
60.8
|
1.0
|
HA2
|
A:GLY405
|
4.2
|
48.3
|
1.0
|
CA
|
A:GLU404
|
4.3
|
36.8
|
1.0
|
HG2
|
A:GLU404
|
4.3
|
60.8
|
1.0
|
CG
|
A:GLU407
|
4.4
|
53.0
|
1.0
|
OD1
|
A:ASP155
|
4.5
|
58.0
|
1.0
|
HG2
|
A:GLU407
|
4.5
|
63.7
|
1.0
|
HA
|
A:ASP155
|
4.5
|
68.8
|
1.0
|
C
|
A:GLU404
|
4.5
|
38.4
|
1.0
|
CA
|
A:GLY405
|
4.6
|
40.2
|
1.0
|
CB
|
A:GLU404
|
4.6
|
37.8
|
1.0
|
HG3
|
A:GLU407
|
4.8
|
63.7
|
1.0
|
HB2
|
A:GLU404
|
4.9
|
45.4
|
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
|