SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4ubq'

List of Similar Pattern of Amino Acids

Hit pattern: 3D amino acid arrangements similar to known drug binding site
Query pattern: Residues from known binding site for annotated drug that match the hit pattern

(Click on the DrReposER ID to view details on interfaces and similar patterns of amino acids)
(Click on the view link on the last column to view superposed patterns of amino acids)
Filter list by:
DrReposER ID / Desc. Hit
PDBID		 Hit
Macromolecule		 Res.
Matches		 Interface HETATM RMSD Dali
Z-score		 Seq.
Identity (%)		 View Dock
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2BR4_F_SAMF301_1
(CEPHALOSPORIN
HYDROXYLASE CMCI)		 4ubq BETA-LACTAMASE
(Acinetobacter
baumannii) 		3 / 3 LYS A 112
ASP A  49
CYH A 159
 None
None
ZN  A 302 (-1.8A)
 1.04A 2br4F-4ubqA:
undetectable		 2br4F-4ubqA:
22.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2C2B_A_SAMA500_0
(THREONINE SYNTHASE
1, CHLOROPLASTIC)		 4ubq BETA-LACTAMASE
(Acinetobacter
baumannii) 		5 / 10 SER A 123
GLY A 121
SER A 120
PHE A 119
LEU A 126
 None
 1.28A 2c2bA-4ubqA:
undetectable
2c2bB-4ubqA:
undetectable		 2c2bA-4ubqA:
17.52
2c2bB-4ubqA:
17.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2C2B_B_SAMB500_0
(THREONINE SYNTHASE
1, CHLOROPLASTIC)		 4ubq BETA-LACTAMASE
(Acinetobacter
baumannii) 		5 / 10 LEU A 126
SER A 123
GLY A 121
SER A 120
PHE A 119
 None
 1.23A 2c2bA-4ubqA:
undetectable
2c2bB-4ubqA:
undetectable		 2c2bA-4ubqA:
17.52
2c2bB-4ubqA:
17.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2C2B_C_SAMC500_0
(THREONINE SYNTHASE
1, CHLOROPLASTIC)		 4ubq BETA-LACTAMASE
(Acinetobacter
baumannii) 		5 / 10 SER A 123
GLY A 121
SER A 120
PHE A 119
LEU A 126
 None
 1.27A 2c2bC-4ubqA:
1.4
2c2bD-4ubqA:
0.0		 2c2bC-4ubqA:
17.52
2c2bD-4ubqA:
17.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2C2B_E_SAME500_0
(THREONINE SYNTHASE
1, CHLOROPLASTIC)		 4ubq BETA-LACTAMASE
(Acinetobacter
baumannii) 		5 / 11 SER A 123
GLY A 121
SER A 120
PHE A 119
LEU A 126
 None
 1.24A 2c2bE-4ubqA:
undetectable
2c2bF-4ubqA:
undetectable		 2c2bE-4ubqA:
17.52
2c2bF-4ubqA:
17.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2C2B_F_SAMF500_0
(THREONINE SYNTHASE
1, CHLOROPLASTIC)		 4ubq BETA-LACTAMASE
(Acinetobacter
baumannii) 		5 / 10 LEU A 126
SER A 123
GLY A 121
SER A 120
PHE A 119
 None
 1.26A 2c2bE-4ubqA:
undetectable
2c2bF-4ubqA:
undetectable		 2c2bE-4ubqA:
17.52
2c2bF-4ubqA:
17.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2HDN_J_TACJ5888_1
(ELONGATION FACTOR
EF-TU)		 4ubq BETA-LACTAMASE
(Acinetobacter
baumannii) 		4 / 6 THR A  53
SER A  22
ASP A  56
VAL A  32
 None
 1.27A 2hdnI-4ubqA:
undetectable
2hdnJ-4ubqA:
undetectable
2hdnL-4ubqA:
undetectable		 2hdnI-4ubqA:
13.07
2hdnJ-4ubqA:
20.31
2hdnL-4ubqA:
20.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2HDN_L_TACL6888_1
(ELONGATION FACTOR
EF-TU)		 4ubq BETA-LACTAMASE
(Acinetobacter
baumannii) 		4 / 6 VAL A  32
THR A  53
SER A  22
ASP A  56
 None
 1.29A 2hdnJ-4ubqA:
undetectable
2hdnK-4ubqA:
undetectable
2hdnL-4ubqA:
undetectable		 2hdnJ-4ubqA:
20.31
2hdnK-4ubqA:
13.07
2hdnL-4ubqA:
20.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2OXT_A_SAMA300_1
(NUCLEOSIDE-2'-O-METH
YLTRANSFERASE)		 4ubq BETA-LACTAMASE
(Acinetobacter
baumannii) 		3 / 3 SER A 180
HIS A  78
ASP A 110
 None
ZN  A 301 (-3.4A)
None
 0.53A 2oxtA-4ubqA:
undetectable		 2oxtA-4ubqA:
21.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ZJ0_A_2FAA500_2
(ADENOSYLHOMOCYSTEINA
SE)		 4ubq BETA-LACTAMASE
(Acinetobacter
baumannii) 		4 / 5 GLN A 213
THR A 210
THR A 141
HIS A  78
 None
None
None
ZN  A 301 (-3.4A)
 1.28A 2zj0A-4ubqA:
2.8		 2zj0A-4ubqA:
18.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ZJ0_B_2FAB500_2
(ADENOSYLHOMOCYSTEINA
SE)		 4ubq BETA-LACTAMASE
(Acinetobacter
baumannii) 		4 / 5 GLN A 213
THR A 210
THR A 141
HIS A  78
 None
None
None
ZN  A 301 (-3.4A)
 1.25A 2zj0B-4ubqA:
3.2		 2zj0B-4ubqA:
18.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ZJ0_C_2FAC500_2
(ADENOSYLHOMOCYSTEINA
SE)		 4ubq BETA-LACTAMASE
(Acinetobacter
baumannii) 		4 / 5 GLN A 213
THR A 210
THR A 141
HIS A  78
 None
None
None
ZN  A 301 (-3.4A)
 1.23A 2zj0C-4ubqA:
3.0		 2zj0C-4ubqA:
18.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3CE6_A_ADNA500_2
(ADENOSYLHOMOCYSTEINA
SE)		 4ubq BETA-LACTAMASE
(Acinetobacter
baumannii) 		4 / 5 GLN A 213
THR A 210
THR A 141
HIS A  78
 None
None
None
ZN  A 301 (-3.4A)
 1.22A 3ce6A-4ubqA:
2.8		 3ce6A-4ubqA:
18.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3CE6_B_ADNB500_2
(ADENOSYLHOMOCYSTEINA
SE)		 4ubq BETA-LACTAMASE
(Acinetobacter
baumannii) 		4 / 5 GLN A 213
THR A 210
THR A 141
HIS A  78
 None
None
None
ZN  A 301 (-3.4A)
 1.21A 3ce6B-4ubqA:
3.1		 3ce6B-4ubqA:
18.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3CE6_C_ADNC500_2
(ADENOSYLHOMOCYSTEINA
SE)		 4ubq BETA-LACTAMASE
(Acinetobacter
baumannii) 		4 / 5 GLN A 213
THR A 210
THR A 141
HIS A  78
 None
None
None
ZN  A 301 (-3.4A)
 1.20A 3ce6C-4ubqA:
2.9		 3ce6C-4ubqA:
18.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3G1U_A_ADNA438_2
(ADENOSYLHOMOCYSTEINA
SE)		 4ubq BETA-LACTAMASE
(Acinetobacter
baumannii) 		4 / 4 GLN A 213
THR A 210
THR A 141
HIS A  78
 None
None
None
ZN  A 301 (-3.4A)
 1.18A 3g1uA-4ubqA:
3.5		 3g1uA-4ubqA:
19.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3G1U_C_ADNC438_2
(ADENOSYLHOMOCYSTEINA
SE)		 4ubq BETA-LACTAMASE
(Acinetobacter
baumannii) 		4 / 5 GLN A 213
THR A 210
THR A 141
HIS A  78
 None
None
None
ZN  A 301 (-3.4A)
 1.21A 3g1uC-4ubqA:
2.5		 3g1uC-4ubqA:
19.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3GLQ_A_RABA602_2
(ADENOSYLHOMOCYSTEINA
SE)		 4ubq BETA-LACTAMASE
(Acinetobacter
baumannii) 		4 / 5 GLN A 213
THR A 210
THR A 141
HIS A  78
 None
None
None
ZN  A 301 (-3.4A)
 1.19A 3glqA-4ubqA:
3.3		 3glqA-4ubqA:
19.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3GLQ_B_RABB602_2
(ADENOSYLHOMOCYSTEINA
SE)		 4ubq BETA-LACTAMASE
(Acinetobacter
baumannii) 		4 / 5 GLN A 213
THR A 210
THR A 141
HIS A  78
 None
None
None
ZN  A 301 (-3.4A)
 1.18A 3glqB-4ubqA:
2.5		 3glqB-4ubqA:
19.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3N58_A_ADNA500_2
(ADENOSYLHOMOCYSTEINA
SE)		 4ubq BETA-LACTAMASE
(Acinetobacter
baumannii) 		4 / 5 GLN A 213
THR A 210
THR A 141
HIS A  78
 None
None
None
ZN  A 301 (-3.4A)
 1.17A 3n58A-4ubqA:
3.4		 3n58A-4ubqA:
19.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4AQL_A_TXCA1452_1
(GUANINE DEAMINASE)		 4ubq BETA-LACTAMASE
(Acinetobacter
baumannii) 		5 / 12 HIS A 140
ALA A 181
HIS A  78
SER A  83
ASP A  82
 ZN  A 301 ( 3.3A)
None
ZN  A 301 (-3.4A)
None
ZN  A 302 (-3.0A)
 1.25A 4aqlA-4ubqA:
undetectable		 4aqlA-4ubqA:
20.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4C1D_A_X8ZA350_1
(BETA-LACTAMASE CLASS
B VIM-2)		 4ubq BETA-LACTAMASE
(Acinetobacter
baumannii) 		6 / 9 HIS A  80
ASP A  82
HIS A 140
CYH A 159
ASN A 168
HIS A 198
 ZN  A 301 ( 3.2A)
ZN  A 302 (-3.0A)
ZN  A 301 ( 3.3A)
ZN  A 302 (-1.8A)
ACT  A 303 (-4.4A)
ZN  A 302 ( 3.8A)
 0.36A 4c1dA-4ubqA:
31.6		 4c1dA-4ubqA:
29.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4C1D_B_X8ZB350_1
(BETA-LACTAMASE CLASS
B VIM-2)		 4ubq BETA-LACTAMASE
(Acinetobacter
baumannii) 		7 / 10 HIS A  78
HIS A  80
ASP A  82
HIS A 140
CYH A 159
ASN A 168
HIS A 198
 ZN  A 301 (-3.4A)
ZN  A 301 ( 3.2A)
ZN  A 302 (-3.0A)
ZN  A 301 ( 3.3A)
ZN  A 302 (-1.8A)
ACT  A 303 (-4.4A)
ZN  A 302 ( 3.8A)
 0.36A 4c1dB-4ubqA:
31.5		 4c1dB-4ubqA:
29.72
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4C1F_A_X8ZA300_1
(BETA-LACTAMASE IMP-1)		 4ubq BETA-LACTAMASE
(Acinetobacter
baumannii) 		7 / 11 HIS A  78
HIS A  80
ASP A  82
HIS A 140
CYH A 159
LYS A 162
HIS A 198
 ZN  A 301 (-3.4A)
ZN  A 301 ( 3.2A)
ZN  A 302 (-3.0A)
ZN  A 301 ( 3.3A)
ZN  A 302 (-1.8A)
ACT  A 303 (-2.8A)
ZN  A 302 ( 3.8A)
 0.42A 4c1fA-4ubqA:
40.1
4c1fB-4ubqA:
38.7		 4c1fA-4ubqA:
88.65
4c1fB-4ubqA:
88.65
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4C1F_A_X8ZA300_1
(BETA-LACTAMASE IMP-1)		 4ubq BETA-LACTAMASE
(Acinetobacter
baumannii) 		7 / 11 HIS A  78
HIS A  80
ASP A  82
HIS A 140
LYS A 162
ASN A 168
HIS A 198
 ZN  A 301 (-3.4A)
ZN  A 301 ( 3.2A)
ZN  A 302 (-3.0A)
ZN  A 301 ( 3.3A)
ACT  A 303 (-2.8A)
ACT  A 303 (-4.4A)
ZN  A 302 ( 3.8A)
 0.63A 4c1fA-4ubqA:
40.1
4c1fB-4ubqA:
38.7		 4c1fA-4ubqA:
88.65
4c1fB-4ubqA:
88.65
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4C1F_A_X8ZA300_1
(BETA-LACTAMASE IMP-1)		 4ubq BETA-LACTAMASE
(Acinetobacter
baumannii) 		6 / 11 TRP A  29
HIS A  78
ASP A  82
HIS A 140
CYH A 159
HIS A 198
 None
ZN  A 301 (-3.4A)
ZN  A 302 (-3.0A)
ZN  A 301 ( 3.3A)
ZN  A 302 (-1.8A)
ZN  A 302 ( 3.8A)
 1.40A 4c1fA-4ubqA:
40.1
4c1fB-4ubqA:
38.7		 4c1fA-4ubqA:
88.65
4c1fB-4ubqA:
88.65
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4C1H_A_X8ZA305_1
(BETA-LACTAMASE 2)		 4ubq BETA-LACTAMASE
(Acinetobacter
baumannii) 		6 / 9 HIS A  78
HIS A  80
ASP A  82
HIS A 140
CYH A 159
HIS A 198
 ZN  A 301 (-3.4A)
ZN  A 301 ( 3.2A)
ZN  A 302 (-3.0A)
ZN  A 301 ( 3.3A)
ZN  A 302 (-1.8A)
ZN  A 302 ( 3.8A)
 0.42A 4c1hA-4ubqA:
31.5		 4c1hA-4ubqA:
34.30
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4C1H_A_X8ZA305_1
(BETA-LACTAMASE 2)		 4ubq BETA-LACTAMASE
(Acinetobacter
baumannii) 		6 / 9 HIS A  78
HIS A  80
ASP A  82
HIS A 140
GLY A 167
HIS A 198
 ZN  A 301 (-3.4A)
ZN  A 301 ( 3.2A)
ZN  A 302 (-3.0A)
ZN  A 301 ( 3.3A)
ACT  A 303 ( 3.7A)
ZN  A 302 ( 3.8A)
 0.70A 4c1hA-4ubqA:
31.5		 4c1hA-4ubqA:
34.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4CLA_A_CLMA221_0
(TYPE III
CHLORAMPHENICOL
ACETYLTRANSFERASE)		 4ubq BETA-LACTAMASE
(Acinetobacter
baumannii) 		5 / 11 ALA A  99
PHE A 119
SER A  83
PHE A 156
ILE A  48
 None
 1.41A 4claA-4ubqA:
undetectable		 4claA-4ubqA:
21.43
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4EXS_A_X8ZA301_1
(BETA-LACTAMASE NDM-1)		 4ubq BETA-LACTAMASE
(Acinetobacter
baumannii) 		5 / 9 VAL A  32
ASP A  82
CYH A 159
ASN A 168
HIS A 198
 None
ZN  A 302 (-3.0A)
ZN  A 302 (-1.8A)
ACT  A 303 (-4.4A)
ZN  A 302 ( 3.8A)
 0.75A 4exsA-4ubqA:
30.8		 4exsA-4ubqA:
31.78
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4EXS_A_X8ZA301_1
(BETA-LACTAMASE NDM-1)		 4ubq BETA-LACTAMASE
(Acinetobacter
baumannii) 		6 / 9 VAL A  32
HIS A  80
ASP A  82
HIS A 140
CYH A 159
HIS A 198
 None
ZN  A 301 ( 3.2A)
ZN  A 302 (-3.0A)
ZN  A 301 ( 3.3A)
ZN  A 302 (-1.8A)
ZN  A 302 ( 3.8A)
 0.38A 4exsA-4ubqA:
30.8		 4exsA-4ubqA:
31.78
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4EXS_B_X8ZB301_1
(BETA-LACTAMASE NDM-1)		 4ubq BETA-LACTAMASE
(Acinetobacter
baumannii) 		7 / 8 VAL A  32
HIS A  80
ASP A  82
HIS A 140
CYH A 159
ASN A 168
HIS A 198
 None
ZN  A 301 ( 3.2A)
ZN  A 302 (-3.0A)
ZN  A 301 ( 3.3A)
ZN  A 302 (-1.8A)
ACT  A 303 (-4.4A)
ZN  A 302 ( 3.8A)
 0.48A 4exsB-4ubqA:
31.3		 4exsB-4ubqA:
31.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4FJP_A_NPSA711_1
(LACTOTRANSFERRIN)		 4ubq BETA-LACTAMASE
(Acinetobacter
baumannii) 		4 / 6 THR A 141
GLY A 139
ASN A 144
GLY A 167
 None
None
None
ACT  A 303 ( 3.7A)
 0.88A 4fjpA-4ubqA:
undetectable		 4fjpA-4ubqA:
23.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4LVC_A_ADNA501_2
(S-ADENOSYL-L-HOMOCYS
TEINE HYDROLASE
(SAHASE))		 4ubq BETA-LACTAMASE
(Acinetobacter
baumannii) 		4 / 5 GLN A 213
THR A 210
THR A 141
HIS A  78
 None
None
None
ZN  A 301 (-3.4A)
 1.15A 4lvcA-4ubqA:
2.8		 4lvcA-4ubqA:
20.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4LVC_C_ADNC501_2
(S-ADENOSYL-L-HOMOCYS
TEINE HYDROLASE
(SAHASE))		 4ubq BETA-LACTAMASE
(Acinetobacter
baumannii) 		4 / 5 GLN A 213
THR A 210
THR A 141
HIS A  78
 None
None
None
ZN  A 301 (-3.4A)
 1.12A 4lvcC-4ubqA:
3.3		 4lvcC-4ubqA:
20.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4N09_A_ADNA401_2
(ADENOSINE KINASE)		 4ubq BETA-LACTAMASE
(Acinetobacter
baumannii) 		4 / 4 LEU A  37
SER A 196
LEU A 155
LEU A  13
 None
 0.97A 4n09A-4ubqA:
undetectable		 4n09A-4ubqA:
21.70
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5A5Z_A_WJZA304_0
(BETA-LACTAMASE NDM-1)		 4ubq BETA-LACTAMASE
(Acinetobacter
baumannii) 		7 / 8 VAL A  32
HIS A  80
ASP A  82
HIS A 140
CYH A 159
ASN A 168
HIS A 198
 None
ZN  A 301 ( 3.2A)
ZN  A 302 (-3.0A)
ZN  A 301 ( 3.3A)
ZN  A 302 (-1.8A)
ACT  A 303 (-4.4A)
ZN  A 302 ( 3.8A)
 0.35A 5a5zA-4ubqA:
31.3		 5a5zA-4ubqA:
32.27
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5A5Z_C_WJZC304_0
(BETA-LACTAMASE NDM-1)		 4ubq BETA-LACTAMASE
(Acinetobacter
baumannii) 		6 / 7 HIS A 140
CYH A 159
LYS A 162
GLY A 167
ASN A 168
HIS A 198
 ZN  A 301 ( 3.3A)
ZN  A 302 (-1.8A)
ACT  A 303 (-2.8A)
ACT  A 303 ( 3.7A)
ACT  A 303 (-4.4A)
ZN  A 302 ( 3.8A)
 0.61A 5a5zC-4ubqA:
31.3		 5a5zC-4ubqA:
32.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5AYA_A_X8ZA307_1
(METALLO-BETA-LACTAMA
SE)		 4ubq BETA-LACTAMASE
(Acinetobacter
baumannii) 		5 / 11 HIS A  78
HIS A  80
ASP A  82
HIS A 140
HIS A 198
 ZN  A 301 (-3.4A)
ZN  A 301 ( 3.2A)
ZN  A 302 (-3.0A)
ZN  A 301 ( 3.3A)
ZN  A 302 ( 3.8A)
 0.84A 5ayaA-4ubqA:
17.4		 5ayaA-4ubqA:
23.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5M8R_A_MMSA511_1
(5,6-DIHYDROXYINDOLE-
2-CARBOXYLIC ACID
OXIDASE)		 4ubq BETA-LACTAMASE
(Acinetobacter
baumannii) 		4 / 7 HIS A 198
HIS A 140
HIS A  78
SER A  83
 ZN  A 302 ( 3.8A)
ZN  A 301 ( 3.3A)
ZN  A 301 (-3.4A)
None
 1.00A 5m8rA-4ubqA:
undetectable		 5m8rA-4ubqA:
20.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5M8R_B_MMSB514_1
(5,6-DIHYDROXYINDOLE-
2-CARBOXYLIC ACID
OXIDASE)		 4ubq BETA-LACTAMASE
(Acinetobacter
baumannii) 		4 / 8 HIS A 198
HIS A 140
HIS A  78
SER A  83
 ZN  A 302 ( 3.8A)
ZN  A 301 ( 3.3A)
ZN  A 301 (-3.4A)
None
 1.01A 5m8rB-4ubqA:
undetectable		 5m8rB-4ubqA:
20.13
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5ZJ8_A_9DCA303_0
(METALLO-BETA-LACTAMA
SE TYPE 2)		 4ubq BETA-LACTAMASE
(Acinetobacter
baumannii) 		6 / 8 HIS A  80
ASP A  82
HIS A 140
CYH A 159
ASN A 168
HIS A 198
 ZN  A 301 ( 3.2A)
ZN  A 302 (-3.0A)
ZN  A 301 ( 3.3A)
ZN  A 302 (-1.8A)
ACT  A 303 (-4.4A)
ZN  A 302 ( 3.8A)
 0.56A 5zj8A-4ubqA:
15.2		 5zj8A-4ubqA:
33.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6APH_A_ADNA501_2
(ADENOSYLHOMOCYSTEINA
SE)		 4ubq BETA-LACTAMASE
(Acinetobacter
baumannii) 		4 / 5 GLN A 213
THR A 210
THR A 141
HIS A  78
 None
None
None
ZN  A 301 (-3.4A)
 1.14A 6aphA-4ubqA:
3.4		 6aphA-4ubqA:
18.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6F3N_A_ADNA505_2
(-)		 4ubq BETA-LACTAMASE
(Acinetobacter
baumannii) 		4 / 4 GLN A 213
THR A 210
THR A 141
HIS A  78
 None
None
None
ZN  A 301 (-3.4A)
 1.24A 6f3nA-4ubqA:
3.1		 6f3nA-4ubqA:
19.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6F3N_C_ADNC505_2
(-)		 4ubq BETA-LACTAMASE
(Acinetobacter
baumannii) 		4 / 4 GLN A 213
THR A 210
THR A 141
HIS A  78
 None
None
None
ZN  A 301 (-3.4A)
 1.24A 6f3nC-4ubqA:
3.1		 6f3nC-4ubqA:
19.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6F3N_D_ADND506_2
(-)		 4ubq BETA-LACTAMASE
(Acinetobacter
baumannii) 		4 / 4 GLN A 213
THR A 210
THR A 141
HIS A  78
 None
None
None
ZN  A 301 (-3.4A)
 1.23A 6f3nD-4ubqA:
3.5		 6f3nD-4ubqA:
19.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6GBN_A_ADNA501_2
(-)		 4ubq BETA-LACTAMASE
(Acinetobacter
baumannii) 		4 / 5 GLN A 213
THR A 210
THR A 141
HIS A  78
 None
None
None
ZN  A 301 (-3.4A)
 1.16A 6gbnA-4ubqA:
undetectable		 6gbnA-4ubqA:
20.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6GBN_B_ADNB501_2
(-)		 4ubq BETA-LACTAMASE
(Acinetobacter
baumannii) 		4 / 5 GLN A 213
THR A 210
THR A 141
HIS A  78
 None
None
None
ZN  A 301 (-3.4A)
 1.16A 6gbnB-4ubqA:
2.7		 6gbnB-4ubqA:
20.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6GBN_C_ADNC501_2
(-)		 4ubq BETA-LACTAMASE
(Acinetobacter
baumannii) 		4 / 5 GLN A 213
THR A 210
THR A 141
HIS A  78
 None
None
None
ZN  A 301 (-3.4A)
 1.16A 6gbnC-4ubqA:
undetectable		 6gbnC-4ubqA:
20.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6GBN_D_ADND501_2
(-)		 4ubq BETA-LACTAMASE
(Acinetobacter
baumannii) 		4 / 5 GLN A 213
THR A 210
THR A 141
HIS A  78
 None
None
None
ZN  A 301 (-3.4A)
 1.18A 6gbnD-4ubqA:
undetectable		 6gbnD-4ubqA:
20.24