Chlorine in PDB 6bla: Structure of AMM01 Fab, An Anti Ebv Gh/Gl Neutralizing Antibody
Protein crystallography data
The structure of Structure of AMM01 Fab, An Anti Ebv Gh/Gl Neutralizing Antibody, PDB code: 6bla
was solved by
M.Pancera,
C.Weidle,
Seattle Structural Genomics Center For Infectiousdisease (Ssgcid),
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
48.81 /
1.55
|
Space group
|
P 21 21 21
|
Cell size a, b, c (Å), α, β, γ (°)
|
49.893,
69.937,
136.313,
90.00,
90.00,
90.00
|
R / Rfree (%)
|
16.6 /
19.4
|
Chlorine Binding Sites:
The binding sites of Chlorine atom in the Structure of AMM01 Fab, An Anti Ebv Gh/Gl Neutralizing Antibody
(pdb code 6bla). This binding sites where shown within
5.0 Angstroms radius around Chlorine atom.
In total 6 binding sites of Chlorine where determined in the
Structure of AMM01 Fab, An Anti Ebv Gh/Gl Neutralizing Antibody, PDB code: 6bla:
Jump to Chlorine binding site number:
1;
2;
3;
4;
5;
6;
Chlorine binding site 1 out
of 6 in 6bla
Go back to
Chlorine Binding Sites List in 6bla
Chlorine binding site 1 out
of 6 in the Structure of AMM01 Fab, An Anti Ebv Gh/Gl Neutralizing Antibody
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 1 of Structure of AMM01 Fab, An Anti Ebv Gh/Gl Neutralizing Antibody within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
H:Cl307
b:30.8
occ:1.00
|
H
|
H:TRP47
|
2.4
|
29.9
|
1.0
|
H
|
L:PHE101
|
2.6
|
30.3
|
1.0
|
HA
|
H:GLU46
|
2.7
|
30.9
|
1.0
|
HA
|
L:VAL100
|
2.8
|
34.3
|
1.0
|
HD2
|
L:PHE101
|
3.1
|
30.1
|
1.0
|
O
|
H:HOH446
|
3.2
|
33.5
|
1.0
|
N
|
H:TRP47
|
3.3
|
24.9
|
1.0
|
N
|
L:PHE101
|
3.4
|
25.2
|
1.0
|
HG13
|
L:VAL100
|
3.5
|
37.4
|
0.5
|
HB3
|
H:TRP47
|
3.6
|
29.7
|
1.0
|
CA
|
H:GLU46
|
3.6
|
25.7
|
1.0
|
HB2
|
L:PHE101
|
3.6
|
30.8
|
1.0
|
CA
|
L:VAL100
|
3.7
|
28.6
|
0.5
|
CA
|
L:VAL100
|
3.7
|
28.5
|
0.5
|
C
|
H:GLU46
|
4.0
|
25.1
|
1.0
|
CD2
|
L:PHE101
|
4.0
|
25.0
|
1.0
|
HG22
|
L:VAL100
|
4.0
|
50.1
|
0.5
|
HB3
|
H:GLU46
|
4.0
|
34.2
|
1.0
|
HB2
|
H:TRP47
|
4.0
|
29.7
|
1.0
|
C
|
L:VAL100
|
4.1
|
27.8
|
1.0
|
HG12
|
L:VAL100
|
4.1
|
50.6
|
0.5
|
HB
|
L:VAL100
|
4.1
|
40.9
|
0.5
|
O
|
H:LEU45
|
4.1
|
27.8
|
1.0
|
CB
|
H:TRP47
|
4.1
|
24.7
|
1.0
|
HG2
|
H:GLU46
|
4.1
|
72.2
|
1.0
|
O
|
L:TYR99
|
4.2
|
28.1
|
1.0
|
CA
|
H:TRP47
|
4.3
|
22.8
|
1.0
|
CB
|
H:GLU46
|
4.3
|
28.5
|
1.0
|
CG1
|
L:VAL100
|
4.3
|
31.1
|
0.5
|
CB
|
L:PHE101
|
4.3
|
25.7
|
1.0
|
O
|
L:HOH457
|
4.4
|
39.2
|
1.0
|
CB
|
L:VAL100
|
4.4
|
34.1
|
0.5
|
CA
|
L:PHE101
|
4.4
|
25.3
|
1.0
|
CB
|
L:VAL100
|
4.5
|
33.9
|
0.5
|
HG12
|
L:VAL100
|
4.6
|
37.4
|
0.5
|
O
|
L:PHE101
|
4.6
|
27.3
|
1.0
|
CG
|
L:PHE101
|
4.6
|
25.8
|
1.0
|
N
|
H:GLU46
|
4.7
|
25.1
|
1.0
|
CG2
|
L:VAL100
|
4.7
|
41.8
|
0.5
|
N
|
L:VAL100
|
4.7
|
27.2
|
1.0
|
O
|
H:TRP47
|
4.7
|
25.9
|
1.0
|
CG1
|
L:VAL100
|
4.7
|
42.1
|
0.5
|
CG
|
H:GLU46
|
4.8
|
60.1
|
1.0
|
C
|
H:LEU45
|
4.8
|
28.4
|
1.0
|
C
|
L:TYR99
|
4.8
|
28.5
|
1.0
|
HE2
|
L:PHE101
|
4.9
|
32.5
|
1.0
|
CE2
|
L:PHE101
|
4.9
|
27.0
|
1.0
|
C
|
L:PHE101
|
5.0
|
26.8
|
1.0
|
|
Chlorine binding site 2 out
of 6 in 6bla
Go back to
Chlorine Binding Sites List in 6bla
Chlorine binding site 2 out
of 6 in the Structure of AMM01 Fab, An Anti Ebv Gh/Gl Neutralizing Antibody
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 2 of Structure of AMM01 Fab, An Anti Ebv Gh/Gl Neutralizing Antibody within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
H:Cl308
b:74.4
occ:1.00
|
HH
|
H:TYR79
|
2.5
|
37.4
|
1.0
|
HE1
|
H:TYR79
|
3.2
|
31.0
|
1.0
|
OH
|
H:TYR79
|
3.3
|
31.1
|
1.0
|
HG21
|
H:THR77
|
3.3
|
32.9
|
1.0
|
HG
|
H:SER21
|
3.6
|
32.7
|
1.0
|
HB2
|
H:SER21
|
3.7
|
31.2
|
1.0
|
HB3
|
H:SER21
|
3.7
|
31.2
|
1.0
|
CE1
|
H:TYR79
|
3.8
|
25.8
|
1.0
|
CZ
|
H:TYR79
|
4.0
|
25.2
|
1.0
|
O
|
H:HOH463
|
4.0
|
37.9
|
1.0
|
HD2
|
H:LYS23
|
4.0
|
0.6
|
1.0
|
CB
|
H:SER21
|
4.0
|
26.0
|
1.0
|
OG
|
H:SER21
|
4.2
|
27.2
|
1.0
|
HG3
|
H:LYS23
|
4.2
|
80.7
|
1.0
|
CG2
|
H:THR77
|
4.2
|
27.4
|
1.0
|
HG23
|
H:THR77
|
4.5
|
32.9
|
1.0
|
H22
|
H:PEG304
|
4.5
|
0.2
|
1.0
|
H12
|
H:PEG304
|
4.7
|
93.2
|
1.0
|
HG22
|
H:THR77
|
4.7
|
32.9
|
1.0
|
O
|
H:HOH432
|
4.8
|
25.7
|
1.0
|
CD
|
H:LYS23
|
4.8
|
0.1
|
1.0
|
HG2
|
H:LYS23
|
4.8
|
80.7
|
1.0
|
CG
|
H:LYS23
|
4.8
|
67.2
|
1.0
|
O
|
H:HOH549
|
4.8
|
41.7
|
1.0
|
OG1
|
H:THR77
|
4.9
|
27.9
|
1.0
|
O
|
H:HOH425
|
4.9
|
36.6
|
1.0
|
|
Chlorine binding site 3 out
of 6 in 6bla
Go back to
Chlorine Binding Sites List in 6bla
Chlorine binding site 3 out
of 6 in the Structure of AMM01 Fab, An Anti Ebv Gh/Gl Neutralizing Antibody
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 3 of Structure of AMM01 Fab, An Anti Ebv Gh/Gl Neutralizing Antibody within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
H:Cl309
b:83.8
occ:1.00
|
HG13
|
L:VAL44
|
3.6
|
38.1
|
1.0
|
O
|
H:HOH462
|
3.7
|
32.8
|
1.0
|
HE1
|
H:TYR108
|
3.9
|
41.1
|
1.0
|
O
|
L:HOH430
|
4.2
|
34.0
|
1.0
|
O
|
L:HOH412
|
4.2
|
47.7
|
1.0
|
HG22
|
L:VAL44
|
4.2
|
36.4
|
1.0
|
HD1
|
H:TYR108
|
4.2
|
33.3
|
1.0
|
O
|
H:HOH499
|
4.3
|
34.6
|
1.0
|
CE1
|
H:TYR108
|
4.3
|
34.2
|
1.0
|
CG1
|
L:VAL44
|
4.5
|
31.7
|
1.0
|
CD1
|
H:TYR108
|
4.5
|
27.7
|
1.0
|
HG11
|
L:VAL44
|
4.6
|
38.1
|
1.0
|
O
|
H:ASP107
|
4.8
|
28.9
|
1.0
|
CG2
|
L:VAL44
|
5.0
|
30.3
|
1.0
|
|
Chlorine binding site 4 out
of 6 in 6bla
Go back to
Chlorine Binding Sites List in 6bla
Chlorine binding site 4 out
of 6 in the Structure of AMM01 Fab, An Anti Ebv Gh/Gl Neutralizing Antibody
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 4 of Structure of AMM01 Fab, An Anti Ebv Gh/Gl Neutralizing Antibody within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
L:Cl309
b:64.6
occ:1.00
|
O
|
L:HOH549
|
2.8
|
31.0
|
1.0
|
O2
|
L:EDO304
|
2.8
|
40.0
|
1.0
|
O
|
L:HOH559
|
2.8
|
44.8
|
1.0
|
H22
|
L:EDO304
|
3.0
|
73.6
|
1.0
|
HB3
|
L:ARG60
|
3.1
|
34.8
|
1.0
|
HG3
|
L:GLU59
|
3.3
|
0.2
|
1.0
|
C2
|
L:EDO304
|
3.4
|
61.3
|
1.0
|
HG2
|
L:GLU59
|
3.8
|
0.2
|
1.0
|
CG
|
L:GLU59
|
4.0
|
0.5
|
1.0
|
H
|
L:ARG60
|
4.0
|
32.6
|
1.0
|
O1
|
L:EDO304
|
4.1
|
36.5
|
1.0
|
CB
|
L:ARG60
|
4.1
|
28.9
|
1.0
|
H21
|
L:EDO304
|
4.1
|
73.6
|
1.0
|
OE2
|
L:GLU59
|
4.2
|
71.2
|
1.0
|
HD3
|
L:ARG60
|
4.3
|
35.5
|
1.0
|
N
|
L:ARG60
|
4.3
|
27.1
|
1.0
|
C1
|
L:EDO304
|
4.4
|
58.3
|
1.0
|
HA
|
L:ARG60
|
4.4
|
34.3
|
1.0
|
CA
|
L:ARG60
|
4.5
|
28.6
|
1.0
|
HH11
|
L:ARG60
|
4.6
|
39.6
|
1.0
|
HB2
|
L:ARG60
|
4.6
|
34.8
|
1.0
|
O
|
L:HOH557
|
4.6
|
39.5
|
1.0
|
CD
|
L:GLU59
|
4.6
|
0.5
|
1.0
|
HO1
|
L:EDO304
|
4.7
|
43.8
|
1.0
|
HB2
|
L:ARG76
|
4.8
|
33.0
|
1.0
|
HG2
|
L:ARG60
|
4.9
|
33.8
|
1.0
|
C
|
L:GLU59
|
4.9
|
28.2
|
1.0
|
H11
|
L:EDO304
|
4.9
|
70.0
|
1.0
|
CG
|
L:ARG60
|
4.9
|
28.1
|
1.0
|
|
Chlorine binding site 5 out
of 6 in 6bla
Go back to
Chlorine Binding Sites List in 6bla
Chlorine binding site 5 out
of 6 in the Structure of AMM01 Fab, An Anti Ebv Gh/Gl Neutralizing Antibody
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 5 of Structure of AMM01 Fab, An Anti Ebv Gh/Gl Neutralizing Antibody within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
L:Cl310
b:62.1
occ:1.00
|
O
|
L:ALA42
|
3.1
|
27.3
|
1.0
|
O
|
L:HOH507
|
3.2
|
39.5
|
1.0
|
HG23
|
L:VAL44
|
3.2
|
36.4
|
1.0
|
HB3
|
L:ALA42
|
3.3
|
39.3
|
1.0
|
HB3
|
L:GLN41
|
3.3
|
36.7
|
1.0
|
HG22
|
L:VAL44
|
3.3
|
36.4
|
1.0
|
H
|
L:ALA42
|
3.6
|
35.5
|
1.0
|
CG2
|
L:VAL44
|
3.7
|
30.3
|
1.0
|
HG21
|
L:VAL44
|
3.9
|
36.4
|
1.0
|
C
|
L:ALA42
|
3.9
|
26.1
|
1.0
|
N
|
L:ALA42
|
4.0
|
29.6
|
1.0
|
CB
|
L:ALA42
|
4.1
|
32.7
|
1.0
|
OE1
|
L:GLN41
|
4.2
|
38.1
|
1.0
|
O
|
L:HOH508
|
4.2
|
26.6
|
1.0
|
CA
|
L:ALA42
|
4.2
|
29.2
|
1.0
|
O
|
L:PRO43
|
4.2
|
27.6
|
1.0
|
O
|
L:HOH412
|
4.3
|
47.7
|
1.0
|
CB
|
L:GLN41
|
4.3
|
30.6
|
1.0
|
O
|
H:HOH522
|
4.3
|
33.9
|
1.0
|
HB2
|
L:GLN41
|
4.6
|
36.7
|
1.0
|
HB1
|
L:ALA42
|
4.7
|
39.3
|
1.0
|
C
|
L:PRO43
|
4.7
|
26.8
|
1.0
|
HB2
|
L:ALA42
|
4.7
|
39.3
|
1.0
|
C
|
L:GLN41
|
4.8
|
31.0
|
1.0
|
CD
|
L:GLN41
|
4.9
|
43.7
|
1.0
|
N
|
L:PRO43
|
4.9
|
25.7
|
1.0
|
HA
|
L:GLN41
|
5.0
|
37.0
|
1.0
|
|
Chlorine binding site 6 out
of 6 in 6bla
Go back to
Chlorine Binding Sites List in 6bla
Chlorine binding site 6 out
of 6 in the Structure of AMM01 Fab, An Anti Ebv Gh/Gl Neutralizing Antibody
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 6 of Structure of AMM01 Fab, An Anti Ebv Gh/Gl Neutralizing Antibody within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
L:Cl311
b:78.2
occ:1.00
|
H
|
L:SER9
|
2.5
|
35.8
|
1.0
|
HD2
|
L:PRO8
|
2.5
|
42.7
|
1.0
|
O
|
L:SER9
|
2.8
|
32.7
|
1.0
|
HG
|
L:SER9
|
3.2
|
45.5
|
1.0
|
N
|
L:SER9
|
3.3
|
29.8
|
1.0
|
HB2
|
L:PRO7
|
3.3
|
39.8
|
1.0
|
CD
|
L:PRO8
|
3.4
|
35.5
|
1.0
|
OG
|
L:SER9
|
3.5
|
37.9
|
1.0
|
N
|
L:PRO8
|
3.7
|
31.2
|
1.0
|
C
|
L:SER9
|
3.7
|
30.9
|
1.0
|
HB2
|
L:PRO8
|
3.9
|
43.1
|
1.0
|
CA
|
L:SER9
|
3.9
|
32.2
|
1.0
|
HG2
|
L:PRO8
|
4.0
|
53.5
|
1.0
|
HD3
|
L:PRO8
|
4.1
|
42.7
|
1.0
|
CB
|
L:PRO7
|
4.1
|
33.2
|
1.0
|
CG
|
L:PRO8
|
4.2
|
44.5
|
1.0
|
HB3
|
L:PRO7
|
4.2
|
39.8
|
1.0
|
C
|
L:PRO8
|
4.2
|
26.9
|
1.0
|
C
|
L:PRO7
|
4.3
|
32.6
|
1.0
|
O
|
L:HOH538
|
4.3
|
48.3
|
1.0
|
CB
|
L:SER9
|
4.3
|
38.9
|
1.0
|
CB
|
L:PRO8
|
4.3
|
35.9
|
1.0
|
CA
|
L:PRO8
|
4.3
|
28.7
|
1.0
|
HA
|
L:PRO7
|
4.5
|
38.1
|
1.0
|
CA
|
L:PRO7
|
4.5
|
31.7
|
1.0
|
HA
|
L:SER9
|
4.8
|
38.7
|
1.0
|
HB3
|
L:SER9
|
4.9
|
46.8
|
1.0
|
O
|
L:HOH561
|
5.0
|
42.8
|
1.0
|
HB2
|
L:SER9
|
5.0
|
46.8
|
1.0
|
O
|
L:HOH524
|
5.0
|
42.4
|
1.0
|
N
|
L:VAL10
|
5.0
|
26.8
|
1.0
|
|
Reference:
J.Snijder,
M.S.Ortego,
C.Weidle,
A.B.Stuart,
M.D.Gray,
M.J.Mcelrath,
M.Pancera,
D.Veesler,
A.T.Mcguire.
An Antibody Targeting the Fusion Machinery Neutralizes Dual-Tropic Infection and Defines A Site of Vulnerability on Epstein-Barr Virus. Immunity V. 48 799 2018.
ISSN: ISSN 1097-4180
PubMed: 29669253
DOI: 10.1016/J.IMMUNI.2018.03.026
Page generated: Fri Jul 26 22:52:41 2024
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