SIMILAR PATTERNS OF AMINO ACIDS FOR 1OQ5_A_CELA701

List of similar pattern of amino acids derived from ASSAM search

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 link on the last column to view superposed patterns of amino acids in NGL viewer)
(Note that only 3-12 residue patterns can be used for ASSAM searches)
Filter list by:
Hit Macromolecule/
Organism		 Pfam Res. 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.
1ccz PROTEIN (CD58)

(Homo sapiens) 		PF05790
(C2-set) 		5 GLU A  74
PHE A  15
VAL A  13
LEU A  67
THR A  68
 None
 1.13A 1oq5A-1cczA:
undetectable		 1oq5A-1cczA:
20.23
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.
1ci5 PROTEIN (LYMPHOCYTE
FUNCTION-ASSOCIATED
ANTIGEN 3(CD58))

(Homo sapiens) 		no annotation 5 GLU A  74
PHE A  15
VAL A  13
LEU A  67
THR A  68
 None
 1.15A 1oq5A-1ci5A:
undetectable		 1oq5A-1ci5A:
15.95
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.
1ci5 PROTEIN (LYMPHOCYTE
FUNCTION-ASSOCIATED
ANTIGEN 3(CD58))

(Homo sapiens) 		no annotation 5 GLU A  76
PHE A  15
VAL A  13
LEU A  67
THR A  68
 None
 1.14A 1oq5A-1ci5A:
undetectable		 1oq5A-1ci5A:
15.95
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.
1dcq PYK2-ASSOCIATED
PROTEIN BETA

(Mus musculus) 		PF01412
(ArfGap)
PF12796
(Ank_2) 		5 ASN A 278
HIS A 291
VAL A 255
LEU A 282
THR A 283
 None
 1.04A 1oq5A-1dcqA:
undetectable		 1oq5A-1dcqA:
20.34
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.
1fx7 IRON-DEPENDENT
REPRESSOR IDER

(Mycobacterium
tuberculosis) 		PF01325
(Fe_dep_repress)
PF02742
(Fe_dep_repr_C)
PF04023
(FeoA) 		5 VAL A 227
VAL A 163
LEU A 157
THR A 155
PRO A 158
 None
None
None
CO  A2009 ( 4.9A)
None
 1.17A 1oq5A-1fx7A:
undetectable		 1oq5A-1fx7A:
18.96
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1jd0 CARBONIC ANHYDRASE
XII

(Homo sapiens) 		PF00194
(Carb_anhydrase) 		5 ASN A  62
HIS A  96
LEU A 198
THR A 199
PRO A 202
 None
ZN  A 901 ( 3.2A)
AZM  A1400 (-3.9A)
AZM  A1400 (-3.6A)
None
 0.98A 1oq5A-1jd0A:
36.6		 1oq5A-1jd0A:
36.33
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1jd0 CARBONIC ANHYDRASE
XII

(Homo sapiens) 		PF00194
(Carb_anhydrase) 		8 GLN A  92
HIS A  94
HIS A  96
VAL A 121
LEU A 198
THR A 199
PRO A 202
TRP A 209
 AZM  A1400 (-3.2A)
ZN  A 901 ( 3.2A)
ZN  A 901 ( 3.2A)
AZM  A1400 (-4.6A)
AZM  A1400 (-3.9A)
AZM  A1400 (-3.6A)
None
None
 0.48A 1oq5A-1jd0A:
36.6		 1oq5A-1jd0A:
36.33
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1kop CARBONIC ANHYDRASE

(Neisseria
gonorrhoeae) 		PF00194
(Carb_anhydrase) 		6 ASN A  64
GLU A  62
GLN A  69
HIS A  94
LEU A 176
THR A 177
 BME  A 303 (-4.7A)
None
None
ZN  A 301 ( 3.3A)
AZI  A 305 (-4.2A)
AZI  A 305 (-3.4A)
 1.40A 1oq5A-1kopA:
29.7		 1oq5A-1kopA:
33.96
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1kop CARBONIC ANHYDRASE

(Neisseria
gonorrhoeae) 		PF00194
(Carb_anhydrase) 		6 ASN A  64
GLU A  62
HIS A  94
LEU A 176
THR A 177
PRO A 180
 BME  A 303 (-4.7A)
None
ZN  A 301 ( 3.3A)
AZI  A 305 (-4.2A)
AZI  A 305 (-3.4A)
None
 1.24A 1oq5A-1kopA:
29.7		 1oq5A-1kopA:
33.96
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1kop CARBONIC ANHYDRASE

(Neisseria
gonorrhoeae) 		PF00194
(Carb_anhydrase) 		8 GLN A  90
HIS A  92
HIS A  94
VAL A 113
LEU A 176
THR A 177
PRO A 180
TRP A 187
 None
ZN  A 301 ( 3.2A)
ZN  A 301 ( 3.3A)
None
AZI  A 305 (-4.2A)
AZI  A 305 (-3.4A)
None
None
 0.46A 1oq5A-1kopA:
29.7		 1oq5A-1kopA:
33.96
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1kop CARBONIC ANHYDRASE

(Neisseria
gonorrhoeae) 		PF00194
(Carb_anhydrase) 		6 GLU A  62
GLN A  69
HIS A  92
HIS A  94
LEU A 176
THR A 177
 None
None
ZN  A 301 ( 3.2A)
ZN  A 301 ( 3.3A)
AZI  A 305 (-4.2A)
AZI  A 305 (-3.4A)
 1.29A 1oq5A-1kopA:
29.7		 1oq5A-1kopA:
33.96
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1kop CARBONIC ANHYDRASE

(Neisseria
gonorrhoeae) 		PF00194
(Carb_anhydrase) 		6 GLU A  62
HIS A  92
HIS A  94
LEU A 176
THR A 177
PRO A 180
 None
ZN  A 301 ( 3.2A)
ZN  A 301 ( 3.3A)
AZI  A 305 (-4.2A)
AZI  A 305 (-3.4A)
None
 1.12A 1oq5A-1kopA:
29.7		 1oq5A-1kopA:
33.96
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1rj6 CARBONIC ANHYDRASE
XIV

(Mus musculus) 		PF00194
(Carb_anhydrase) 		6 ASN A  62
GLN A  67
HIS A  96
LEU A 198
THR A 199
PRO A 202
 None
None
ZN  A 601 (-3.3A)
AZM  A 400 (-3.7A)
AZM  A 400 (-3.6A)
None
 1.34A 1oq5A-1rj6A:
37.3		 1oq5A-1rj6A:
37.31
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1rj6 CARBONIC ANHYDRASE
XIV

(Mus musculus) 		PF00194
(Carb_anhydrase) 		6 ASN A  62
HIS A  96
LEU A 198
THR A 199
PRO A 202
TRP A 209
 None
ZN  A 601 (-3.3A)
AZM  A 400 (-3.7A)
AZM  A 400 (-3.6A)
None
None
 1.34A 1oq5A-1rj6A:
37.3		 1oq5A-1rj6A:
37.31
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1rj6 CARBONIC ANHYDRASE
XIV

(Mus musculus) 		PF00194
(Carb_anhydrase) 		6 GLN A  67
HIS A  94
HIS A  96
LEU A 198
THR A 199
PRO A 202
 None
ZN  A 601 ( 3.3A)
ZN  A 601 (-3.3A)
AZM  A 400 (-3.7A)
AZM  A 400 (-3.6A)
None
 1.13A 1oq5A-1rj6A:
37.3		 1oq5A-1rj6A:
37.31
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1rj6 CARBONIC ANHYDRASE
XIV

(Mus musculus) 		PF00194
(Carb_anhydrase) 		8 GLN A  92
HIS A  94
HIS A  96
VAL A 121
LEU A 198
THR A 199
PRO A 202
TRP A 209
 AZM  A 400 (-4.3A)
ZN  A 601 ( 3.3A)
ZN  A 601 (-3.3A)
AZM  A 400 (-4.8A)
AZM  A 400 (-3.7A)
AZM  A 400 (-3.6A)
None
None
 0.48A 1oq5A-1rj6A:
37.3		 1oq5A-1rj6A:
37.31
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1urt CARBONIC ANHYDRASE V

(Mus musculus) 		PF00194
(Carb_anhydrase) 		8 GLN A  92
HIS A  94
HIS A  96
VAL A 121
LEU A 198
THR A 199
PRO A 202
TRP A 209
 None
ZN  A 280 (-3.2A)
ZN  A 280 (-3.2A)
None
None
ZN  A 280 ( 4.9A)
None
None
 0.43A 1oq5A-1urtA:
36.9		 1oq5A-1urtA:
51.13
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1urt CARBONIC ANHYDRASE V

(Mus musculus) 		PF00194
(Carb_anhydrase) 		8 GLU A  69
GLN A  92
HIS A  94
HIS A  96
LEU A 198
THR A 199
PRO A 202
TRP A 209
 None
None
ZN  A 280 (-3.2A)
ZN  A 280 (-3.2A)
None
ZN  A 280 ( 4.9A)
None
None
 0.72A 1oq5A-1urtA:
36.9		 1oq5A-1urtA:
51.13
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1urt CARBONIC ANHYDRASE V

(Mus musculus) 		PF00194
(Carb_anhydrase) 		6 HIS A  94
HIS A  96
LEU A 198
THR A 199
PRO A 201
TRP A 209
 ZN  A 280 (-3.2A)
ZN  A 280 (-3.2A)
None
ZN  A 280 ( 4.9A)
None
None
 1.38A 1oq5A-1urtA:
36.9		 1oq5A-1urtA:
51.13
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1urt CARBONIC ANHYDRASE V

(Mus musculus) 		PF00194
(Carb_anhydrase) 		5 HIS A  96
VAL A 143
LEU A 198
THR A 199
PRO A 202
 ZN  A 280 (-3.2A)
None
None
ZN  A 280 ( 4.9A)
None
 0.92A 1oq5A-1urtA:
36.9		 1oq5A-1urtA:
51.13
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1y7w HALOTOLERANT
ALPHA-TYPE CARBONIC
ANHYDRASE (DCA II)

(Dunaliella
salina) 		PF00194
(Carb_anhydrase) 		7 GLN A 113
HIS A 115
HIS A 117
VAL A 137
LEU A 216
THR A 217
TRP A 227
 None
ZN  A 283 ( 3.2A)
ZN  A 283 (-3.2A)
ACY  A 279 ( 4.7A)
ACY  A 279 (-4.3A)
ACY  A 279 (-3.4A)
None
 0.17A 1oq5A-1y7wA:
26.3		 1oq5A-1y7wA:
31.94
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.
2b0o UPLC1

(Homo sapiens) 		PF01412
(ArfGap)
PF12796
(Ank_2) 		5 ASN E 455
HIS E 468
VAL E 432
LEU E 459
THR E 460
 None
 1.09A 1oq5A-2b0oE:
undetectable		 1oq5A-2b0oE:
23.27
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2it4 CARBONIC ANHYDRASE 1

(Homo sapiens) 		PF00194
(Carb_anhydrase) 		7 GLN A  92
HIS A  94
HIS A  96
LEU A 198
THR A 199
PRO A 202
TRP A 209
 None
ZN  A 561 ( 3.2A)
ZN  A 561 ( 3.2A)
PPF  A 500 (-3.9A)
PPF  A 500 (-3.6A)
None
None
 0.55A 1oq5A-2it4A:
41.0		 1oq5A-2it4A:
60.55
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2it4 CARBONIC ANHYDRASE 1

(Homo sapiens) 		PF00194
(Carb_anhydrase) 		6 GLN A  92
HIS A  96
PHE A  91
LEU A 198
THR A 199
TRP A 209
 None
ZN  A 561 ( 3.2A)
None
PPF  A 500 (-3.9A)
PPF  A 500 (-3.6A)
None
 1.24A 1oq5A-2it4A:
41.0		 1oq5A-2it4A:
60.55
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2it4 CARBONIC ANHYDRASE 1

(Homo sapiens) 		PF00194
(Carb_anhydrase) 		5 HIS A  96
VAL A 143
LEU A 198
THR A 199
PRO A 202
 ZN  A 561 ( 3.2A)
PPF  A 500 (-4.9A)
PPF  A 500 (-3.9A)
PPF  A 500 (-3.6A)
None
 0.85A 1oq5A-2it4A:
41.0		 1oq5A-2it4A:
60.55
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.
2mp4 ACTIN-DEPOLYMERIZING
FACTOR 1, ISOFORMS
A/B

(Caenorhabditis
elegans) 		PF00241
(Cofilin_ADF) 		5 VAL A  84
PHE A  30
VAL A  11
LEU A 133
THR A 135
 None
 0.83A 1oq5A-2mp4A:
undetectable		 1oq5A-2mp4A:
20.22
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2w2j CARBONIC
ANHYDRASE-RELATED
PROTEIN

(Homo sapiens) 		PF00194
(Carb_anhydrase) 		6 HIS A 118
VAL A 157
LEU A 222
THR A 223
PRO A 226
TRP A 233
 CL  A 401 (-4.2A)
None
None
CL  A 401 ( 4.8A)
None
None
 0.39A 1oq5A-2w2jA:
37.5		 1oq5A-2w2jA:
38.72
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2znc CARBONIC ANHYDRASE
IV

(Mus musculus) 		PF00194
(Carb_anhydrase) 		7 GLN A  92
HIS A  94
HIS A  96
VAL A 121
LEU A 198
THR A 199
TRP A 209
 None
ZN  A   1 ( 3.3A)
ZN  A   1 ( 3.3A)
None
None
ZN  A   1 ( 4.7A)
None
 0.35A 1oq5A-2zncA:
32.0		 1oq5A-2zncA:
35.56
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.
3b1b CARBONIC ANHYDRASE 1

(Chlamydomonas
reinhardtii) 		PF00194
(Carb_anhydrase) 		5 ASN A 110
HIS A 165
LEU A 259
THR A 260
PRO A 263
 None
ZN  A 378 (-3.3A)
None
ZN  A 378 ( 4.5A)
None
 0.89A 1oq5A-3b1bA:
25.4		 1oq5A-3b1bA:
25.45
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.
3b1b CARBONIC ANHYDRASE 1

(Chlamydomonas
reinhardtii) 		PF00194
(Carb_anhydrase) 		8 GLN A 161
HIS A 163
HIS A 165
VAL A 184
LEU A 259
THR A 260
PRO A 263
TRP A 270
 None
ZN  A 378 (-3.2A)
ZN  A 378 (-3.3A)
None
None
ZN  A 378 ( 4.5A)
None
None
 0.37A 1oq5A-3b1bA:
25.4		 1oq5A-3b1bA:
25.45
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.
3b1b CARBONIC ANHYDRASE 1

(Chlamydomonas
reinhardtii) 		PF00194
(Carb_anhydrase) 		5 HIS A 165
VAL A 201
LEU A 259
THR A 260
PRO A 263
 ZN  A 378 (-3.3A)
None
None
ZN  A 378 ( 4.5A)
None
 1.15A 1oq5A-3b1bA:
25.4		 1oq5A-3b1bA:
25.45
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3da2 CARBONIC ANHYDRASE
13

(Homo sapiens) 		PF00194
(Carb_anhydrase) 		6 ASN A  68
GLN A  93
HIS A  95
PHE A 132
LEU A 199
PRO A 203
 None
4MD  A 401 (-3.1A)
ZN  A 301 ( 3.6A)
4MD  A 401 (-4.6A)
4MD  A 401 (-4.2A)
4MD  A 401 ( 4.9A)
 0.93A 1oq5A-3da2A:
42.5		 1oq5A-3da2A:
59.54
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3da2 CARBONIC ANHYDRASE
13

(Homo sapiens) 		PF00194
(Carb_anhydrase) 		9 ASN A  68
HIS A  95
HIS A  97
VAL A 122
PHE A 132
LEU A 199
THR A 200
PRO A 203
TRP A 210
 None
ZN  A 301 ( 3.6A)
ZN  A 301 ( 3.5A)
4MD  A 401 ( 4.6A)
4MD  A 401 (-4.6A)
4MD  A 401 (-4.2A)
4MD  A 401 (-3.2A)
4MD  A 401 ( 4.9A)
None
 0.49A 1oq5A-3da2A:
42.5		 1oq5A-3da2A:
59.54
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3fe4 CARBONIC ANHYDRASE 6

(Homo sapiens) 		PF00194
(Carb_anhydrase) 		7 GLN A 109
HIS A 111
HIS A 113
VAL A 140
LEU A 219
THR A 220
TRP A 230
 None
MG  A 901 (-3.4A)
MG  A 901 (-3.4A)
None
None
None
None
 0.68A 1oq5A-3fe4A:
31.1		 1oq5A-3fe4A:
34.25
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3fe4 CARBONIC ANHYDRASE 6

(Homo sapiens) 		PF00194
(Carb_anhydrase) 		5 VAL A 140
LEU A 219
THR A 220
PRO A 223
TRP A 230
 None
 0.58A 1oq5A-3fe4A:
31.1		 1oq5A-3fe4A:
34.25
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3jxf RECEPTOR-TYPE
TYROSINE-PROTEIN
PHOSPHATASE ZETA

(Homo sapiens) 		PF00194
(Carb_anhydrase) 		6 HIS A 129
PHE A 166
VAL A 170
LEU A 235
THR A 236
PRO A 239
 None
 1.15A 1oq5A-3jxfA:
33.6		 1oq5A-3jxfA:
30.29
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3jxf RECEPTOR-TYPE
TYROSINE-PROTEIN
PHOSPHATASE ZETA

(Homo sapiens) 		PF00194
(Carb_anhydrase) 		6 HIS A 129
VAL A 170
LEU A 235
THR A 236
PRO A 239
TRP A 246
 None
 0.72A 1oq5A-3jxfA:
33.6		 1oq5A-3jxfA:
30.29
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.
3l6g BETAINE ABC
TRANSPORTER PERMEASE
AND SUBSTRATE
BINDING PROTEIN

(Lactococcus
lactis) 		PF04069
(OpuAC) 		5 VAL A 568
PHE A 572
VAL A 529
LEU A 340
TRP A 535
 None
 0.94A 1oq5A-3l6gA:
undetectable		 1oq5A-3l6gA:
20.36
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.
3lvr ARF-GAP WITH SH3
DOMAIN, ANK REPEAT
AND PH
DOMAIN-CONTAINING
PROTEIN 3,
ADP-RIBOSYLATION
FACTOR 6

(Homo sapiens;
synthetic
construct) 		PF00025
(Arf)
PF01412
(ArfGap)
PF12796
(Ank_2) 		5 ASN E 455
HIS E 468
VAL E 432
LEU E 459
THR E 460
 None
 1.13A 1oq5A-3lvrE:
undetectable		 1oq5A-3lvrE:
20.77
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ml5 CARBONIC ANHYDRASE 7

(Homo sapiens) 		PF00194
(Carb_anhydrase) 		5 ASN A  62
HIS A  96
LEU A 198
THR A 199
PRO A 202
 None
ZN  A 263 ( 3.2A)
AZM  A 264 (-3.4A)
AZM  A 264 (-3.4A)
None
 0.99A 1oq5A-3ml5A:
43.3		 1oq5A-3ml5A:
55.81
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ml5 CARBONIC ANHYDRASE 7

(Homo sapiens) 		PF00194
(Carb_anhydrase) 		9 GLN A  92
HIS A  94
HIS A  96
VAL A 121
PHE A 131
LEU A 198
THR A 199
PRO A 202
TRP A 209
 AZM  A 264 (-4.1A)
ZN  A 263 ( 3.2A)
ZN  A 263 ( 3.2A)
AZM  A 264 (-4.7A)
AZM  A 264 (-4.4A)
AZM  A 264 (-3.4A)
AZM  A 264 (-3.4A)
None
None
 0.31A 1oq5A-3ml5A:
43.3		 1oq5A-3ml5A:
55.81
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ml5 CARBONIC ANHYDRASE 7

(Homo sapiens) 		PF00194
(Carb_anhydrase) 		7 GLN A  92
HIS A  94
HIS A  96
VAL A 121
PHE A 131
LEU A 198
THR A 200
 AZM  A 264 (-4.1A)
ZN  A 263 ( 3.2A)
ZN  A 263 ( 3.2A)
AZM  A 264 (-4.7A)
AZM  A 264 (-4.4A)
AZM  A 264 (-3.4A)
AZM  A 264 (-3.5A)
 1.48A 1oq5A-3ml5A:
43.3		 1oq5A-3ml5A:
55.81
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ml5 CARBONIC ANHYDRASE 7

(Homo sapiens) 		PF00194
(Carb_anhydrase) 		6 HIS A 119
HIS A  96
VAL A 143
LEU A 198
THR A 199
PRO A 202
 ZN  A 263 ( 3.1A)
ZN  A 263 ( 3.2A)
AZM  A 264 ( 4.9A)
AZM  A 264 (-3.4A)
AZM  A 264 (-3.4A)
None
 1.47A 1oq5A-3ml5A:
43.3		 1oq5A-3ml5A:
55.81
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.
3psh PROTEIN HI_1472

(Haemophilus
influenzae) 		PF01497
(Peripla_BP_2) 		5 GLU A 118
GLN A 122
VAL A 109
LEU A 101
PRO A  90
 None
 1.15A 1oq5A-3pshA:
undetectable		 1oq5A-3pshA:
22.09
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3q31 CARBONIC ANHYDRASE

(Aspergillus
oryzae) 		PF00194
(Carb_anhydrase) 		8 GLN A 121
HIS A 123
HIS A 125
VAL A 144
LEU A 214
THR A 215
PRO A 218
TRP A 225
 MLT  A   3 (-3.9A)
ZN  A   1 ( 3.2A)
ZN  A   1 (-3.3A)
None
MLT  A   3 ( 4.2A)
MLT  A   3 ( 4.3A)
None
MLT  A   3 (-4.9A)
 0.46A 1oq5A-3q31A:
24.8		 1oq5A-3q31A:
30.69
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3q31 CARBONIC ANHYDRASE

(Aspergillus
oryzae) 		PF00194
(Carb_anhydrase) 		5 GLU A  95
HIS A 123
HIS A 125
LEU A 214
THR A 215
 None
ZN  A   1 ( 3.2A)
ZN  A   1 (-3.3A)
MLT  A   3 ( 4.2A)
MLT  A   3 ( 4.3A)
 1.18A 1oq5A-3q31A:
24.8		 1oq5A-3q31A:
30.69
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3q31 CARBONIC ANHYDRASE

(Aspergillus
oryzae) 		PF00194
(Carb_anhydrase) 		5 HIS A 125
VAL A 154
LEU A 214
THR A 215
PRO A 218
 ZN  A   1 (-3.3A)
MLT  A   3 (-4.6A)
MLT  A   3 ( 4.2A)
MLT  A   3 ( 4.3A)
None
 1.14A 1oq5A-3q31A:
24.8		 1oq5A-3q31A:
30.69
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3uyq CARBONIC ANHYDRASE 3

(Homo sapiens) 		PF00194
(Carb_anhydrase) 		7 GLN A  92
HIS A  94
HIS A  96
VAL A 121
PHE A 130
THR A 198
PRO A 201
 None
ZN  A 261 (-3.3A)
ZN  A 261 (-3.3A)
None
None
ZN  A 261 ( 4.4A)
None
 0.47A 1oq5A-3uyqA:
41.0		 1oq5A-3uyqA:
58.46
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3uyq CARBONIC ANHYDRASE 3

(Homo sapiens) 		PF00194
(Carb_anhydrase) 		7 GLN A  92
HIS A  94
HIS A  96
VAL A 121
PHE A 130
THR A 198
TRP A 208
 None
ZN  A 261 (-3.3A)
ZN  A 261 (-3.3A)
None
None
ZN  A 261 ( 4.4A)
None
 0.38A 1oq5A-3uyqA:
41.0		 1oq5A-3uyqA:
58.46
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3uyq CARBONIC ANHYDRASE 3

(Homo sapiens) 		PF00194
(Carb_anhydrase) 		6 GLN A  92
HIS A  94
HIS A  96
VAL A 121
PHE A 130
THR A 199
 None
ZN  A 261 (-3.3A)
ZN  A 261 (-3.3A)
None
None
None
 1.29A 1oq5A-3uyqA:
41.0		 1oq5A-3uyqA:
58.46
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.
4crn ERF3 IN RIBOSOME
BOUND
ERF1-ERF3-GDPNP
COMPLEX

(Saccharomyces
cerevisiae) 		PF00009
(GTP_EFTU)
PF03143
(GTP_EFTU_D3)
PF03144
(GTP_EFTU_D2) 		5 ASN P 278
PHE P 264
VAL P 365
LEU P 471
THR P 470
 None
 1.08A 1oq5A-4crnP:
undetectable		 1oq5A-4crnP:
20.93
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4g7a CARBONATE
DEHYDRATASE

(Sulfurihydrogenibium
sp. YO3AOP1) 		PF00194
(Carb_anhydrase) 		5 ASN A  62
HIS A  91
LEU A 173
THR A 174
PRO A 177
 None
ZN  A 301 ( 3.2A)
AZM  A 302 (-3.8A)
AZM  A 302 (-3.4A)
None
 1.02A 1oq5A-4g7aA:
30.1		 1oq5A-4g7aA:
34.27
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4g7a CARBONATE
DEHYDRATASE

(Sulfurihydrogenibium
sp. YO3AOP1) 		PF00194
(Carb_anhydrase) 		8 GLN A  87
HIS A  89
HIS A  91
VAL A 110
LEU A 173
THR A 174
PRO A 177
TRP A 184
 AZM  A 302 (-4.4A)
ZN  A 301 ( 3.2A)
ZN  A 301 ( 3.2A)
AZM  A 302 (-4.7A)
AZM  A 302 (-3.8A)
AZM  A 302 (-3.4A)
None
None
 0.38A 1oq5A-4g7aA:
30.1		 1oq5A-4g7aA:
34.27
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4g7a CARBONATE
DEHYDRATASE

(Sulfurihydrogenibium
sp. YO3AOP1) 		PF00194
(Carb_anhydrase) 		5 HIS A  91
VAL A 120
LEU A 173
THR A 174
PRO A 177
 ZN  A 301 ( 3.2A)
AZM  A 302 ( 4.8A)
AZM  A 302 (-3.8A)
AZM  A 302 (-3.4A)
None
 1.03A 1oq5A-4g7aA:
30.1		 1oq5A-4g7aA:
34.27
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.
4jqs HYPOTHETICAL PROTEIN

(Bacteroides
uniformis) 		PF06283
(ThuA) 		5 HIS A 120
HIS A  48
PHE A 216
VAL A 211
TRP A 148
 None
 1.00A 1oq5A-4jqsA:
undetectable		 1oq5A-4jqsA:
22.11
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4qk3 CARBONIC ANHYDRASE 2

(Homo sapiens) 		PF00194
(Carb_anhydrase) 		7 ASN A  62
HIS A  96
PHE A 131
VAL A 135
LEU A 198
THR A 199
PRO A 202
 None
ZN  A 301 (-3.2A)
None
None
None
ZN  A 301 ( 4.4A)
None
 1.15A 1oq5A-4qk3A:
44.7		 1oq5A-4qk3A:
95.75
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4qk3 CARBONIC ANHYDRASE 2

(Homo sapiens) 		PF00194
(Carb_anhydrase) 		12 ASN A  67
GLU A  69
GLN A  92
HIS A  94
HIS A  96
VAL A 121
PHE A 131
VAL A 135
LEU A 198
THR A 199
PRO A 202
TRP A 209
 None
None
None
ZN  A 301 (-3.2A)
ZN  A 301 (-3.2A)
None
None
None
None
ZN  A 301 ( 4.4A)
None
None
 0.37A 1oq5A-4qk3A:
44.7		 1oq5A-4qk3A:
95.75
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4qk3 CARBONIC ANHYDRASE 2

(Homo sapiens) 		PF00194
(Carb_anhydrase) 		7 GLN A  92
HIS A  94
HIS A  96
VAL A 121
VAL A 135
LEU A 198
THR A 200
 None
ZN  A 301 (-3.2A)
ZN  A 301 (-3.2A)
None
None
None
None
 1.44A 1oq5A-4qk3A:
44.7		 1oq5A-4qk3A:
95.75
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4qk3 CARBONIC ANHYDRASE 2

(Homo sapiens) 		PF00194
(Carb_anhydrase) 		6 HIS A  96
VAL A 143
VAL A 135
LEU A 198
THR A 199
PRO A 202
 ZN  A 301 (-3.2A)
None
None
None
ZN  A 301 ( 4.4A)
None
 1.13A 1oq5A-4qk3A:
44.7		 1oq5A-4qk3A:
95.75
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.
4twl DIOSCORIN 5

(Dioscorea
japonica) 		PF00194
(Carb_anhydrase) 		5 HIS A  97
VAL A 116
THR A 183
PRO A 186
TRP A 193
 ASC  A 303 (-4.4A)
ASC  A 303 (-4.2A)
ASC  A 303 (-3.4A)
None
ASC  A 303 (-4.3A)
 0.31A 1oq5A-4twlA:
28.8		 1oq5A-4twlA:
29.89
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4uov CARBONATE
DEHYDRATASE

(Thermovibrio
ammonificans) 		PF00194
(Carb_anhydrase) 		5 ASN A  85
HIS A 114
LEU A 197
THR A 198
PRO A 201
 None
ZN  A 298 ( 3.2A)
AZM  A 299 (-3.8A)
AZM  A 299 (-3.3A)
None
 1.00A 1oq5A-4uovA:
31.3		 1oq5A-4uovA:
36.71
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4uov CARBONATE
DEHYDRATASE

(Thermovibrio
ammonificans) 		PF00194
(Carb_anhydrase) 		8 GLN A 110
HIS A 112
HIS A 114
VAL A 133
LEU A 197
THR A 198
PRO A 201
TRP A 208
 CL  A 304 ( 3.7A)
ZN  A 298 (-3.2A)
ZN  A 298 ( 3.2A)
None
AZM  A 299 (-3.8A)
AZM  A 299 (-3.3A)
None
None
 0.49A 1oq5A-4uovA:
31.3		 1oq5A-4uovA:
36.71
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4x5s CARBONIC ANHYDRASE
(CARBONATE
DEHYDRATASE)

(Sulfurihydrogenibium
azorense) 		PF00194
(Carb_anhydrase) 		5 ASN A  62
HIS A  91
LEU A 173
THR A 174
PRO A 177
 None
ZN  A 301 ( 3.2A)
AZM  A 302 (-3.7A)
AZM  A 302 (-3.3A)
None
 0.98A 1oq5A-4x5sA:
30.2		 1oq5A-4x5sA:
38.55
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4x5s CARBONIC ANHYDRASE
(CARBONATE
DEHYDRATASE)

(Sulfurihydrogenibium
azorense) 		PF00194
(Carb_anhydrase) 		8 GLN A  87
HIS A  89
HIS A  91
VAL A 110
LEU A 173
THR A 174
PRO A 177
TRP A 184
 AZM  A 302 (-4.3A)
ZN  A 301 ( 3.1A)
ZN  A 301 ( 3.2A)
AZM  A 302 (-4.8A)
AZM  A 302 (-3.7A)
AZM  A 302 (-3.3A)
None
None
 0.38A 1oq5A-4x5sA:
30.2		 1oq5A-4x5sA:
38.55
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4x5s CARBONIC ANHYDRASE
(CARBONATE
DEHYDRATASE)

(Sulfurihydrogenibium
azorense) 		PF00194
(Carb_anhydrase) 		6 HIS A  89
HIS A  91
VAL A 120
LEU A 173
THR A 174
PRO A 177
 ZN  A 301 ( 3.1A)
ZN  A 301 ( 3.2A)
AZM  A 302 ( 4.8A)
AZM  A 302 (-3.7A)
AZM  A 302 (-3.3A)
None
 1.15A 1oq5A-4x5sA:
30.2		 1oq5A-4x5sA:
38.55
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4xfw ALPHA-CARBONIC
ANHYDRASE

(Helicobacter
pylori) 		PF00194
(Carb_anhydrase) 		5 ASN A 108
HIS A 112
VAL A 141
THR A 191
PRO A 194
 None
ZN  A 301 (-3.4A)
None
ZN  A 301 (-4.3A)
None
 0.87A 1oq5A-4xfwA:
26.8		 1oq5A-4xfwA:
30.69
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4xfw ALPHA-CARBONIC
ANHYDRASE

(Helicobacter
pylori) 		PF00194
(Carb_anhydrase) 		7 HIS A 110
HIS A 112
VAL A 131
LEU A 190
THR A 191
PRO A 194
TRP A 201
 ZN  A 301 (-3.3A)
ZN  A 301 (-3.4A)
None
None
ZN  A 301 (-4.3A)
None
None
 0.46A 1oq5A-4xfwA:
26.8		 1oq5A-4xfwA:
30.69
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4xfw ALPHA-CARBONIC
ANHYDRASE

(Helicobacter
pylori) 		PF00194
(Carb_anhydrase) 		5 HIS A 112
VAL A 141
LEU A 190
THR A 191
PRO A 194
 ZN  A 301 (-3.4A)
None
None
ZN  A 301 (-4.3A)
None
 0.88A 1oq5A-4xfwA:
26.8		 1oq5A-4xfwA:
30.69
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4xix CARBONIC ANHYDRASE,
ALPHA TYPE

(Chlamydomonas
reinhardtii) 		PF00194
(Carb_anhydrase) 		8 GLN A 158
HIS A 160
HIS A 162
VAL A 181
LEU A 253
THR A 254
PRO A 257
TRP A 264
 None
ZN  A 401 ( 3.2A)
ZN  A 401 ( 3.2A)
None
2HP  A 402 (-3.4A)
2HP  A 402 (-2.9A)
None
None
 0.44A 1oq5A-4xixA:
26.2		 1oq5A-4xixA:
33.96
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4xix CARBONIC ANHYDRASE,
ALPHA TYPE

(Chlamydomonas
reinhardtii) 		PF00194
(Carb_anhydrase) 		6 GLN A 158
HIS A 160
HIS A 162
VAL A 181
LEU A 253
THR A 255
 None
ZN  A 401 ( 3.2A)
ZN  A 401 ( 3.2A)
None
2HP  A 402 (-3.4A)
2HP  A 402 (-3.6A)
 1.48A 1oq5A-4xixA:
26.2		 1oq5A-4xixA:
33.96
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4xix CARBONIC ANHYDRASE,
ALPHA TYPE

(Chlamydomonas
reinhardtii) 		PF00194
(Carb_anhydrase) 		5 HIS A 162
VAL A 192
LEU A 253
THR A 254
PRO A 257
 ZN  A 401 ( 3.2A)
None
2HP  A 402 (-3.4A)
2HP  A 402 (-2.9A)
None
 1.16A 1oq5A-4xixA:
26.2		 1oq5A-4xixA:
33.96
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4xz5 CARBONIC ANHYDRASE,
ALPHA FAMILY

(Hydrogenovibrio
crunogenus) 		PF00194
(Carb_anhydrase) 		5 ASN A 138
HIS A 167
LEU A 251
THR A 252
PRO A 255
 None
ZN  A 401 ( 3.3A)
BCT  A 402 (-3.8A)
BCT  A 402 (-3.7A)
None
 0.96A 1oq5A-4xz5A:
29.7		 1oq5A-4xz5A:
32.95
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4xz5 CARBONIC ANHYDRASE,
ALPHA FAMILY

(Hydrogenovibrio
crunogenus) 		PF00194
(Carb_anhydrase) 		8 GLN A 163
HIS A 165
HIS A 167
VAL A 186
LEU A 251
THR A 252
PRO A 255
TRP A 262
 None
ZN  A 401 ( 3.2A)
ZN  A 401 ( 3.3A)
None
BCT  A 402 (-3.8A)
BCT  A 402 (-3.7A)
None
None
 0.38A 1oq5A-4xz5A:
29.7		 1oq5A-4xz5A:
32.95
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4xz5 CARBONIC ANHYDRASE,
ALPHA FAMILY

(Hydrogenovibrio
crunogenus) 		PF00194
(Carb_anhydrase) 		5 HIS A 167
VAL A 196
LEU A 251
THR A 252
PRO A 255
 ZN  A 401 ( 3.3A)
None
BCT  A 402 (-3.8A)
BCT  A 402 (-3.7A)
None
 1.04A 1oq5A-4xz5A:
29.7		 1oq5A-4xz5A:
32.95
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.
5aw4 NA, K-ATPASE ALPHA
SUBUNIT

(Squalus
acanthias) 		PF00122
(E1-E2_ATPase)
PF00689
(Cation_ATPase_C)
PF00690
(Cation_ATPase_N)
PF13246
(Cation_ATPase) 		5 GLN A 697
HIS A 666
VAL A 266
LEU A 237
PRO A 236
 None
 1.16A 1oq5A-5aw4A:
undetectable		 1oq5A-5aw4A:
12.87
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.
5b1u METALLO-BETA-LACTAMA
SE

(Serratia
marcescens) 		PF00753
(Lactamase_B) 		5 ASN A  98
HIS A  72
VAL A 203
LEU A 176
THR A 177
 NA  A 303 (-3.6A)
ZN  A 301 (-3.2A)
None
None
HIW  A 321 ( 2.8A)
 1.17A 1oq5A-5b1uA:
undetectable		 1oq5A-5b1uA:
25.87
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5cjf CARBONIC ANHYDRASE
14

(Homo sapiens) 		PF00194
(Carb_anhydrase) 		5 ASN A  62
HIS A  96
LEU A 198
THR A 199
PRO A 202
 GOL  A 303 (-3.9A)
ZN  A 301 ( 3.2A)
520  A 302 (-3.6A)
520  A 302 (-3.4A)
None
 0.96A 1oq5A-5cjfA:
36.9		 1oq5A-5cjfA:
36.80
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5cjf CARBONIC ANHYDRASE
14

(Homo sapiens) 		PF00194
(Carb_anhydrase) 		8 GLN A  92
HIS A  94
HIS A  96
VAL A 121
LEU A 198
THR A 199
PRO A 202
TRP A 209
 GOL  A 303 (-3.2A)
ZN  A 301 (-3.2A)
ZN  A 301 ( 3.2A)
520  A 302 ( 4.9A)
520  A 302 (-3.6A)
520  A 302 (-3.4A)
None
None
 0.39A 1oq5A-5cjfA:
36.9		 1oq5A-5cjfA:
36.80
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5cjf CARBONIC ANHYDRASE
14

(Homo sapiens) 		PF00194
(Carb_anhydrase) 		6 GLN A  92
HIS A  94
HIS A  96
VAL A 121
LEU A 198
THR A 200
 GOL  A 303 (-3.2A)
ZN  A 301 (-3.2A)
ZN  A 301 ( 3.2A)
520  A 302 ( 4.9A)
520  A 302 (-3.6A)
GOL  A 303 ( 3.5A)
 1.50A 1oq5A-5cjfA:
36.9		 1oq5A-5cjfA:
36.80
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5e5u RECEPTOR-TYPE
TYROSINE-PROTEIN
PHOSPHATASE GAMMA

(Mus musculus) 		PF00194
(Carb_anhydrase) 		5 HIS A 151
LEU A 256
THR A 257
PRO A 260
TRP A 267
 None
 0.44A 1oq5A-5e5uA:
34.4		 1oq5A-5e5uA:
31.50
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5e5u RECEPTOR-TYPE
TYROSINE-PROTEIN
PHOSPHATASE GAMMA

(Mus musculus) 		PF00194
(Carb_anhydrase) 		5 HIS A 151
PHE A 187
LEU A 256
THR A 257
TRP A 267
 None
 0.64A 1oq5A-5e5uA:
34.4		 1oq5A-5e5uA:
31.50
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.
5e6p PLEXIN-B2

(Mus musculus) 		PF08337
(Plexin_cytopl) 		5 GLU A1437
HIS A1594
VAL A1469
LEU A1549
THR A1548
 None
 1.03A 1oq5A-5e6pA:
undetectable		 1oq5A-5e6pA:
17.29
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5ezt CARBONIC ANHYDRASE 2

(Bos taurus) 		PF00194
(Carb_anhydrase) 		5 ASN X  61
HIS X  95
LEU X 196
THR X 197
PRO X 200
 None
ZN  X 301 (-3.2A)
None
ZN  X 301 ( 4.4A)
None
 1.12A 1oq5A-5eztX:
44.3		 1oq5A-5eztX:
80.16
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5ezt CARBONIC ANHYDRASE 2

(Bos taurus) 		PF00194
(Carb_anhydrase) 		11 ASN X  66
GLU X  68
GLN X  91
HIS X  93
HIS X  95
VAL X 120
PHE X 129
LEU X 196
THR X 197
PRO X 200
TRP X 207
 None
None
None
ZN  X 301 (-3.2A)
ZN  X 301 (-3.2A)
None
None
None
ZN  X 301 ( 4.4A)
None
None
 0.46A 1oq5A-5eztX:
44.3		 1oq5A-5eztX:
80.16
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5ezt CARBONIC ANHYDRASE 2

(Bos taurus) 		PF00194
(Carb_anhydrase) 		7 GLN X  91
HIS X  93
HIS X  95
VAL X 120
PHE X 129
LEU X 196
THR X 198
 None
ZN  X 301 (-3.2A)
ZN  X 301 (-3.2A)
None
None
None
None
 1.44A 1oq5A-5eztX:
44.3		 1oq5A-5eztX:
80.16
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5ezt CARBONIC ANHYDRASE 2

(Bos taurus) 		PF00194
(Carb_anhydrase) 		5 HIS X  95
VAL X 141
LEU X 196
THR X 197
PRO X 200
 ZN  X 301 (-3.2A)
None
None
ZN  X 301 ( 4.4A)
None
 0.98A 1oq5A-5eztX:
44.3		 1oq5A-5eztX:
80.16
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.
5fx8 LINOLEATE
11-LIPOXYGENASE

(Gaeumannomyces
avenae) 		PF00305
(Lipoxygenase) 		5 GLN A 287
HIS A 290
HIS A 294
PHE A 347
LEU A 336
 None
MN  A1000 (-3.5A)
MN  A1000 (-3.3A)
None
None
 1.16A 1oq5A-5fx8A:
undetectable		 1oq5A-5fx8A:
18.26
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5hpj CARBONIC ANHYDRASE

(Photobacterium
profundum) 		PF00194
(Carb_anhydrase) 		5 ASN A  69
HIS A  98
LEU A 181
THR A 182
PRO A 185
 None
ZN  A 301 (-3.2A)
None
ZN  A 301 ( 4.4A)
None
 1.08A 1oq5A-5hpjA:
29.7		 1oq5A-5hpjA:
35.58
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5hpj CARBONIC ANHYDRASE

(Photobacterium
profundum) 		PF00194
(Carb_anhydrase) 		8 GLN A  94
HIS A  96
HIS A  98
VAL A 117
LEU A 181
THR A 182
PRO A 185
TRP A 192
 None
ZN  A 301 (-3.2A)
ZN  A 301 (-3.2A)
None
None
ZN  A 301 ( 4.4A)
None
None
 0.40A 1oq5A-5hpjA:
29.7		 1oq5A-5hpjA:
35.58
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.
5hzg STRIGOLACTONE
ESTERASE D14

(Arabidopsis
thaliana) 		PF12697
(Abhydrolase_6) 		5 GLU A 140
VAL A 144
PHE A 195
VAL A 194
LEU A 179
 None
 1.18A 1oq5A-5hzgA:
undetectable		 1oq5A-5hzgA:
22.03
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5jn9 CARBONIC ANHYDRASE 4

(Homo sapiens) 		PF00194
(Carb_anhydrase) 		7 GLN A  92
HIS A  94
HIS A  96
VAL A 121
LEU A 198
THR A 199
TRP A 209
 EZL  A 302 (-4.3A)
ZN  A 301 ( 3.3A)
ZN  A 301 ( 3.3A)
EZL  A 302 (-4.7A)
EZL  A 302 (-3.5A)
EZL  A 302 (-3.4A)
None
 0.33A 1oq5A-5jn9A:
33.5		 1oq5A-5jn9A:
35.42
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5jn9 CARBONIC ANHYDRASE 4

(Homo sapiens) 		PF00194
(Carb_anhydrase) 		5 HIS A  94
HIS A  96
VAL A 143
LEU A 198
THR A 199
 ZN  A 301 ( 3.3A)
ZN  A 301 ( 3.3A)
EZL  A 302 ( 4.7A)
EZL  A 302 (-3.5A)
EZL  A 302 (-3.4A)
 1.13A 1oq5A-5jn9A:
33.5		 1oq5A-5jn9A:
35.42
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.
5nuv AUTOPHAGY-RELATED
PROTEIN 16-1

(Homo sapiens) 		PF00400
(WD40) 		5 HIS A 576
VAL A 328
PHE A 330
VAL A 351
LEU A 603
 None
 1.13A 1oq5A-5nuvA:
undetectable		 1oq5A-5nuvA:
22.01
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.
5x7k LIPASE B

(Serratia
marcescens) 		no annotation 5 GLU A 333
VAL A 351
PHE A 353
LEU A 374
THR A 373
 None
 1.17A 1oq5A-5x7kA:
undetectable		 1oq5A-5x7kA:
20.77
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.
6eki CARBONIC ANHYDRASE

(Persephonella
marina) 		no annotation 5 ASN A  90
HIS A 119
LEU A 201
THR A 202
PRO A 205
 None
ZN  A 301 (-3.3A)
None
ZN  A 301 (-4.4A)
None
 1.02A 1oq5A-6ekiA:
30.2		 1oq5A-6ekiA:
16.60
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.
6eki CARBONIC ANHYDRASE

(Persephonella
marina) 		no annotation 8 GLN A 115
HIS A 117
HIS A 119
VAL A 138
LEU A 201
THR A 202
PRO A 205
TRP A 212
 None
ZN  A 301 (-3.3A)
ZN  A 301 (-3.3A)
None
None
ZN  A 301 (-4.4A)
None
None
 0.30A 1oq5A-6ekiA:
30.2		 1oq5A-6ekiA:
16.60
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.
6fe1 CARBONIC ANHYDRASE 9

(Homo sapiens) 		no annotation 5 ASN A  62
HIS A  96
LEU A 198
THR A 199
PRO A 202
 V14  A 302 (-3.4A)
ZN  A 301 ( 3.2A)
V14  A 302 (-3.6A)
V14  A 302 (-3.2A)
None
 1.09A 1oq5A-6fe1A:
33.9		 1oq5A-6fe1A:
14.90
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.
6fe1 CARBONIC ANHYDRASE 9

(Homo sapiens) 		no annotation 8 GLN A  92
HIS A  94
HIS A  96
VAL A 121
LEU A 198
THR A 199
PRO A 202
TRP A 209
 V14  A 302 (-3.8A)
ZN  A 301 ( 3.2A)
ZN  A 301 ( 3.2A)
V14  A 302 (-4.7A)
V14  A 302 (-3.6A)
V14  A 302 (-3.2A)
None
None
 0.47A 1oq5A-6fe1A:
33.9		 1oq5A-6fe1A:
14.90
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.
6fe1 CARBONIC ANHYDRASE 9

(Homo sapiens) 		no annotation 5 GLN A  92
HIS A  94
HIS A  96
VAL A 121
VAL A 131
 V14  A 302 (-3.8A)
ZN  A 301 ( 3.2A)
ZN  A 301 ( 3.2A)
V14  A 302 (-4.7A)
V14  A 302 ( 4.6A)
 1.17A 1oq5A-6fe1A:
33.9		 1oq5A-6fe1A:
14.90
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.
6fe1 CARBONIC ANHYDRASE 9

(Homo sapiens) 		no annotation 5 HIS A  96
VAL A 143
LEU A 198
THR A 199
PRO A 202
 ZN  A 301 ( 3.2A)
None
V14  A 302 (-3.6A)
V14  A 302 (-3.2A)
None
 0.85A 1oq5A-6fe1A:
33.9		 1oq5A-6fe1A:
14.90
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.
1a3q PROTEIN (NUCLEAR
FACTOR KAPPA-B P52)

(Homo sapiens) 		PF00554
(RHD_DNA_bind)
PF16179
(RHD_dimer) 		4 HIS A 107
VAL A 138
THR A 149
LEU A 117
 None
 1.45A 1oq5A-1a3qA:
0.0		 1oq5A-1a3qA:
23.75
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.
1c9l CLATHRIN

(Rattus
norvegicus) 		PF01394
(Clathrin_propel)
PF09268
(Clathrin-link) 		4 HIS A 197
VAL A 220
THR A 168
LEU A 183
 None
 1.28A 1oq5A-1c9lA:
undetectable		 1oq5A-1c9lA:
22.10
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.
1cc1 HYDROGENASE (LARGE
SUBUNIT)

(Desulfomicrobium
baculatum) 		PF00374
(NiFeSe_Hases) 		4 HIS L 498
VAL L 445
THR L 307
LEU L 300
 FE2  L 501 (-3.5A)
None
None
None
 1.44A 1oq5A-1cc1L:
0.0		 1oq5A-1cc1L:
20.08
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.
1gkp HYDANTOINASE

(Thermus sp.) 		PF01979
(Amidohydro_1) 		4 HIS A 239
VAL A 264
THR A 181
LEU A 374
 ZN  A1460 (-3.5A)
None
KCX  A 150 ( 4.3A)
None
 1.46A 1oq5A-1gkpA:
0.0		 1oq5A-1gkpA:
21.30
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.
1gvh FLAVOHEMOPROTEIN

(Escherichia
coli) 		PF00042
(Globin)
PF00175
(NAD_binding_1)
PF00970
(FAD_binding_6) 		4 HIS A 286
VAL A 290
THR A 280
LEU A 275
 None
 1.30A 1oq5A-1gvhA:
0.0		 1oq5A-1gvhA:
20.90
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.
1hux ACTIVATOR OF
(R)-2-HYDROXYGLUTARY
L-COA DEHYDRATASE

(Acidaminococcus
fermentans) 		PF01869
(BcrAD_BadFG) 		4 HIS A  98
VAL A  97
THR A 119
LEU A  83
 None
 1.42A 1oq5A-1huxA:
0.0		 1oq5A-1huxA:
23.45
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.
1hzv NITRITE REDUCTASE

(Pseudomonas
aeruginosa) 		PF02239
(Cytochrom_D1)
PF13442
(Cytochrome_CBB3) 		4 HIS A 434
VAL A 453
THR A 514
LEU A 517
 None
 1.33A 1oq5A-1hzvA:
undetectable		 1oq5A-1hzvA:
19.55
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.
1mbm CHYMOTRYPSIN-LIKE
SERINE PROTEASE

(Equine
arteritis virus) 		PF05579
(Peptidase_S32) 		4 HIS A  39
VAL A  40
THR A 146
LEU A  35
 None
 1.25A 1oq5A-1mbmA:
0.0		 1oq5A-1mbmA:
23.64
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.
1nmo HYPOTHETICAL PROTEIN
YBGI

(Escherichia
coli) 		PF01784
(NIF3) 		4 HIS A  63
VAL A  42
THR A 172
LEU A 150
 FE  A 302 (-3.7A)
None
None
None
 1.38A 1oq5A-1nmoA:
0.0		 1oq5A-1nmoA:
20.50
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.
1t34 ATRIAL NATRIURETIC
PEPTIDE RECEPTOR A

(Rattus
norvegicus) 		PF01094
(ANF_receptor) 		4 HIS A 148
VAL A 420
THR A 182
LEU A 151
 None
 1.18A 1oq5A-1t34A:
undetectable		 1oq5A-1t34A:
21.30
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.
1t6x RIBOFLAVIN
KINASE/FMN
ADENYLYLTRANSFERASE

(Thermotoga
maritima) 		PF01687
(Flavokinase)
PF06574
(FAD_syn) 		4 HIS A  15
VAL A  18
THR A  37
LEU A  34
 None
 1.42A 1oq5A-1t6xA:
undetectable		 1oq5A-1t6xA:
23.20
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.
1v8b ADENOSYLHOMOCYSTEINA
SE

(Plasmodium
falciparum) 		PF00670
(AdoHcyase_NAD)
PF05221
(AdoHcyase) 		4 HIS A 398
VAL A 402
THR A  56
LEU A  61
 ADN  A 502 ( 3.5A)
None
ADN  A 502 (-3.0A)
None
 1.35A 1oq5A-1v8bA:
undetectable		 1oq5A-1v8bA:
20.35
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.
1w66 LIPOYLTRANSFERASE

(Mycobacterium
tuberculosis) 		PF03099
(BPL_LplA_LipB) 		4 HIS A  83
VAL A  89
THR A  74
LEU A 156
 DKA  A 301 ( 4.9A)
None
None
None
 1.13A 1oq5A-1w66A:
undetectable		 1oq5A-1w66A:
21.11
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.
1x94 PUTATIVE
PHOSPHOHEPTOSE
ISOMERASE

(Vibrio cholerae) 		PF13580
(SIS_2) 		4 HIS A 164
VAL A  16
THR A 120
LEU A 144
 None
 1.25A 1oq5A-1x94A:
undetectable		 1oq5A-1x94A:
19.34
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.
2bb0 IMIDAZOLONEPROPIONAS
E

(Bacillus
subtilis) 		PF01979
(Amidohydro_1) 		4 HIS A  80
VAL A 292
THR A 180
LEU A 246
 ZN  A1601 (-3.4A)
None
None
None
 1.46A 1oq5A-2bb0A:
undetectable		 1oq5A-2bb0A:
20.94
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.
2btw ALR0975 PROTEIN

(Nostoc sp. PCC
7120) 		PF05023
(Phytochelatin) 		4 HIS A 143
VAL A 141
THR A 124
LEU A 131
 None
 1.42A 1oq5A-2btwA:
undetectable		 1oq5A-2btwA:
21.45
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.
2d1q LUCIFERIN
4-MONOOXYGENASE

(Luciola
cruciata) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C) 		4 HIS A 223
VAL A 368
THR A 348
LEU A 344
 None
None
None
AMP  A1001 (-4.0A)
 1.38A 1oq5A-2d1qA:
undetectable		 1oq5A-2d1qA:
19.31
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.
2d1q LUCIFERIN
4-MONOOXYGENASE

(Luciola
cruciata) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C) 		4 HIS A 223
VAL A 368
THR A 348
LEU A 420
 None
 1.43A 1oq5A-2d1qA:
undetectable		 1oq5A-2d1qA:
19.31
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.
2e6m WERNER SYNDROME
ATP-DEPENDENT
HELICASE HOMOLOG

(Mus musculus) 		PF01612
(DNA_pol_A_exo1) 		4 HIS A 107
VAL A  93
THR A 200
LEU A 205
 None
 1.29A 1oq5A-2e6mA:
undetectable		 1oq5A-2e6mA:
19.39
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.
2fge ZINC METALLOPROTEASE
(INSULINASE FAMILY)

(Arabidopsis
thaliana) 		PF00675
(Peptidase_M16)
PF05193
(Peptidase_M16_C)
PF08367
(M16C_assoc) 		4 HIS A 247
VAL A 251
THR A 126
LEU A 132
 None
 0.92A 1oq5A-2fgeA:
undetectable		 1oq5A-2fgeA:
13.33
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.
2hdw HYPOTHETICAL PROTEIN
PA2218

(Pseudomonas
aeruginosa) 		PF02129
(Peptidase_S15) 		4 HIS A 274
VAL A 108
THR A  53
LEU A  50
 None
 1.46A 1oq5A-2hdwA:
undetectable		 1oq5A-2hdwA:
22.10
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.
2hne L-FUCONATE
DEHYDRATASE

(Xanthomonas
campestris) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		4 HIS A  10
VAL A  38
THR A  64
LEU A  70
 None
 1.36A 1oq5A-2hneA:
undetectable		 1oq5A-2hneA:
18.04
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.
2i71 HYPOTHETICAL PROTEIN

(Sulfolobus
solfataricus) 		PF09455
(Cas_DxTHG) 		4 HIS A 109
VAL A  86
THR A 104
LEU A 136
 MG  A 402 ( 4.8A)
MG  A 402 (-3.9A)
None
None
 1.35A 1oq5A-2i71A:
undetectable		 1oq5A-2i71A:
21.60
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.
2j16 TYROSINE-PROTEIN
PHOSPHATASE YIL113W

(Saccharomyces
cerevisiae) 		PF00782
(DSPc) 		4 HIS B 139
VAL B  85
THR B  75
LEU B  80
 None
 1.30A 1oq5A-2j16B:
undetectable		 1oq5A-2j16B:
20.62
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.
2juh TELOMERE BINDING
PROTEIN TBP1

(Nicotiana
glutinosa) 		PF00249
(Myb_DNA-binding) 		4 HIS A 654
VAL A 627
THR A 597
LEU A 619
 None
 1.27A 1oq5A-2juhA:
undetectable		 1oq5A-2juhA:
18.53
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.
2nzt HEXOKINASE-2

(Homo sapiens) 		PF00349
(Hexokinase_1)
PF03727
(Hexokinase_2) 		4 HIS A 420
VAL A 416
THR A 380
LEU A 385
 None
 1.45A 1oq5A-2nztA:
undetectable		 1oq5A-2nztA:
14.69
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.
2qo3 ERYAII ERYTHROMYCIN
POLYKETIDE SYNTHASE
MODULES 3 AND 4

(Saccharopolyspora
erythraea) 		PF00109
(ketoacyl-synt)
PF00698
(Acyl_transf_1)
PF02801
(Ketoacyl-synt_C)
PF16197
(KAsynt_C_assoc) 		4 HIS A 650
VAL A 834
THR A 784
LEU A 817
 None
 1.13A 1oq5A-2qo3A:
undetectable		 1oq5A-2qo3A:
14.56
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.
2x8w METHYLGLYOXAL
SYNTHASE

(Thermus sp. GH5) 		PF02142
(MGS) 		4 HIS A   9
VAL A  92
THR A  38
LEU A  53
 MLI  A1126 (-4.5A)
None
MLI  A1126 (-3.6A)
None
 1.36A 1oq5A-2x8wA:
undetectable		 1oq5A-2x8wA:
18.97
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.
2xio PUTATIVE
DEOXYRIBONUCLEASE
TATDN1

(Homo sapiens) 		PF01026
(TatD_DNase) 		4 HIS A 174
VAL A 172
THR A  73
LEU A 144
 EDO  A1299 (-4.1A)
None
None
None
 1.27A 1oq5A-2xioA:
undetectable		 1oq5A-2xioA:
21.00
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.
2xwb COMPLEMENT C3B
ALPHA' CHAIN

(Homo sapiens) 		PF00207
(A2M)
PF01759
(NTR)
PF07677
(A2M_recep)
PF07678
(A2M_comp)
PF10569
(Thiol-ester_cl) 		4 HIS B1327
VAL B 949
THR B 883
LEU B1488
 None
 1.26A 1oq5A-2xwbB:
undetectable		 1oq5A-2xwbB:
15.11
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.
2yev CYTOCHROME C OXIDASE
POLYPEPTIDE I+III

(Thermus
thermophilus) 		PF00115
(COX1)
PF00510
(COX3) 		4 HIS A 736
VAL A 733
THR A 664
LEU A 657
 None
 1.33A 1oq5A-2yevA:
undetectable		 1oq5A-2yevA:
15.11
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.
2yev CYTOCHROME C OXIDASE
POLYPEPTIDE I+III

(Thermus
thermophilus) 		PF00115
(COX1)
PF00510
(COX3) 		4 HIS A 736
VAL A 733
THR A 664
LEU A 659
 None
 1.48A 1oq5A-2yevA:
undetectable		 1oq5A-2yevA:
15.11
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.
3fhh OUTER MEMBRANE HEME
RECEPTOR SHUA

(Shigella
dysenteriae) 		PF00593
(TonB_dep_Rec)
PF07715
(Plug) 		4 HIS A  44
VAL A 567
THR A  34
LEU A 609
 PB  A 645 (-4.4A)
None
None
None
 1.41A 1oq5A-3fhhA:
undetectable		 1oq5A-3fhhA:
16.48
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.
3gf8 PUTATIVE
POLYSACCHARIDE
BINDING PROTEINS
(DUF1812)

(Bacteroides
thetaiotaomicron) 		PF08842
(Mfa2) 		4 HIS A 204
VAL A 149
THR A 121
LEU A  72
 None
 1.34A 1oq5A-3gf8A:
undetectable		 1oq5A-3gf8A:
21.94
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.
3h0g DNA-DIRECTED RNA
POLYMERASE II
SUBUNIT RPB9

(Schizosaccharomyces
pombe) 		PF01096
(TFIIS_C)
PF02150
(RNA_POL_M_15KD) 		4 HIS I  60
VAL I  58
THR I  64
LEU I  68
 None
 1.44A 1oq5A-3h0gI:
undetectable		 1oq5A-3h0gI:
16.06
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.
3h0k UPF0200 PROTEIN
SSO1041

(Sulfolobus
solfataricus) 		PF13238
(AAA_18) 		4 HIS A  85
VAL A  88
THR A  82
LEU A 105
 None
 1.39A 1oq5A-3h0kA:
undetectable		 1oq5A-3h0kA:
19.78
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.
3i4e ISOCITRATE LYASE

(Burkholderia
pseudomallei) 		PF00463
(ICL) 		4 HIS A 181
VAL A 152
THR A 348
LEU A  66
 None
 1.18A 1oq5A-3i4eA:
undetectable		 1oq5A-3i4eA:
19.59
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.
3jrp FUSION PROTEIN OF
PROTEIN TRANSPORT
PROTEIN SEC13 AND
NUCLEOPORIN NUP145

(Saccharomyces
cerevisiae) 		PF00400
(WD40) 		4 HIS A  43
VAL A  38
THR A  26
LEU A  70
 None
 1.37A 1oq5A-3jrpA:
undetectable		 1oq5A-3jrpA:
22.71
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.
3kf3 INVERTASE

(Schwanniomyces
occidentalis) 		PF00251
(Glyco_hydro_32N)
PF08244
(Glyco_hydro_32C) 		4 HIS A 118
VAL A 116
THR A  59
LEU A  62
 None
 1.21A 1oq5A-3kf3A:
undetectable		 1oq5A-3kf3A:
19.80
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.
3kmu INTEGRIN-LINKED
KINASE

(Homo sapiens) 		PF07714
(Pkinase_Tyr) 		4 HIS A 247
VAL A 250
THR A 310
LEU A 314
 None
 1.35A 1oq5A-3kmuA:
undetectable		 1oq5A-3kmuA:
22.71
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.
3lg3 ISOCITRATE LYASE

(Yersinia pestis) 		PF00463
(ICL) 		4 HIS A 185
VAL A 156
THR A 352
LEU A  70
 None
 1.16A 1oq5A-3lg3A:
undetectable		 1oq5A-3lg3A:
21.75
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.
3llx PREDICTED AMINO ACID
ALDOLASE OR RACEMASE

(Idiomarina
loihiensis) 		PF01168
(Ala_racemase_N)
PF14031
(D-ser_dehydrat) 		4 HIS A 164
VAL A 121
THR A 166
LEU A 111
 None
 1.35A 1oq5A-3llxA:
undetectable		 1oq5A-3llxA:
21.43
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.
3lqc DNA POLYMERASE BETA

(Rattus
norvegicus) 		PF14791
(DNA_pol_B_thumb)
PF14792
(DNA_pol_B_palm) 		4 HIS B 212
VAL B 215
THR B 233
LEU B 194
 None
 1.47A 1oq5A-3lqcB:
undetectable		 1oq5A-3lqcB:
23.86
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.
3m70 TELLURITE RESISTANCE
PROTEIN TEHB HOMOLOG

(Haemophilus
influenzae) 		PF03848
(TehB)
PF09313
(DUF1971) 		4 HIS A 109
VAL A 112
THR A 106
LEU A 136
 None
 1.42A 1oq5A-3m70A:
undetectable		 1oq5A-3m70A:
20.20
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.
3my7 ALCOHOL
DEHYDROGENASE/ACETAL
DEHYDE DEHYDROGENASE

(Vibrio
parahaemolyticus) 		PF00171
(Aldedh) 		4 HIS A 438
VAL A 434
THR A 130
LEU A 125
 None
 1.48A 1oq5A-3my7A:
undetectable		 1oq5A-3my7A:
19.78
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.
3nv0 NTF2-RELATED EXPORT
PROTEIN
NUCLEAR RNA EXPORT
FACTOR 2

(Caenorhabditis
elegans) 		PF02136
(NTF2)
no annotation 		4 HIS A 337
VAL A 322
THR B 116
LEU A 326
 None
 1.19A 1oq5A-3nv0A:
undetectable		 1oq5A-3nv0A:
21.64
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.
3ob8 BETA-GALACTOSIDASE

(Kluyveromyces
lactis) 		PF00703
(Glyco_hydro_2)
PF02836
(Glyco_hydro_2_C)
PF02837
(Glyco_hydro_2_N)
PF02929
(Bgal_small_N) 		4 HIS A  16
VAL A  15
THR A  22
LEU A 464
 None
 1.22A 1oq5A-3ob8A:
undetectable		 1oq5A-3ob8A:
15.46
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.
3pih UVRABC SYSTEM
PROTEIN A

(Thermotoga
maritima) 		PF00005
(ABC_tran) 		4 HIS A 852
VAL A 855
THR A 582
LEU A 585
 None
 1.20A 1oq5A-3pihA:
undetectable		 1oq5A-3pihA:
16.67
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.
3tkk PREDICTED
ACETAMIDASE/FORMAMID
ASE

(Caldanaerobacter
subterraneus) 		PF03069
(FmdA_AmdA) 		4 HIS A 244
VAL A 243
THR A 258
LEU A 264
 None
 1.37A 1oq5A-3tkkA:
undetectable		 1oq5A-3tkkA:
20.80
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.
3vsj 2-AMINO-5-CHLOROPHEN
OL 1,6-DIOXYGENASE
ALPHA SUBUNIT
2-AMINO-5-CHLOROPHEN
OL 1,6-DIOXYGENASE
BETA SUBUNIT

(Comamonas
testosteroni) 		PF02900
(LigB) 		4 HIS B  69
VAL B 116
THR B  65
LEU A 181
 None
 1.47A 1oq5A-3vsjB:
undetectable		 1oq5A-3vsjB:
20.61
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.
3wso F-BOX ONLY PROTEIN
44

(Homo sapiens) 		PF04300
(FBA)
PF12937
(F-box-like) 		4 HIS A 211
VAL A 160
THR A 190
LEU A 181
 None
 1.21A 1oq5A-3wsoA:
undetectable		 1oq5A-3wsoA:
20.98
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.
3x3y PHENYLETHYLAMINE
OXIDASE

(Arthrobacter
globiformis) 		PF01179
(Cu_amine_oxid)
PF02728
(Cu_amine_oxidN3) 		4 HIS A 170
VAL A 159
THR A 408
LEU A 156
 GOL  A 708 (-3.8A)
GOL  A 708 ( 4.7A)
None
None
 1.43A 1oq5A-3x3yA:
undetectable		 1oq5A-3x3yA:
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.
3zdb PROTEIN XNI

(Escherichia
coli) 		PF01367
(5_3_exonuc)
PF02739
(5_3_exonuc_N) 		4 HIS A 119
VAL A 114
THR A  43
LEU A   6
 None
 1.48A 1oq5A-3zdbA:
undetectable		 1oq5A-3zdbA:
24.05
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.
3zdj ENCA BETA-LACTAMASE

(synthetic
construct) 		PF13354
(Beta-lactamase2) 		4 HIS A 112
VAL A 108
THR A 118
LEU A 138
 None
 1.49A 1oq5A-3zdjA:
undetectable		 1oq5A-3zdjA:
22.44
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.
3zv8 3C PROTEASE

(Enterovirus D) 		PF00548
(Peptidase_C3) 		4 HIS A  31
VAL A  30
THR A 180
LEU A 175
 None
 1.21A 1oq5A-3zv8A:
undetectable		 1oq5A-3zv8A:
21.90
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.
4bed HEMOCYANIN KLH1

(Megathura
crenulata) 		PF00264
(Tyrosinase)
PF14830
(Haemocyan_bet_s) 		4 HIS B3182
VAL B3190
THR B3000
LEU B3054
 None
 1.10A 1oq5A-4bedB:
undetectable		 1oq5A-4bedB:
9.80
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.
4bsn EXPORTIN-1

(Homo sapiens) 		PF03810
(IBN_N)
PF08389
(Xpo1)
PF08767
(CRM1_C) 		4 HIS A 481
VAL A 484
THR A 519
LEU A 525
 None
 1.47A 1oq5A-4bsnA:
undetectable		 1oq5A-4bsnA:
12.91
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.
4f0j PROBABLE HYDROLYTIC
ENZYME

(Pseudomonas
aeruginosa) 		PF00561
(Abhydrolase_1) 		4 HIS A 141
VAL A 165
THR A 271
LEU A 292
 EDO  A 408 ( 3.7A)
None
EDO  A 407 ( 4.0A)
None
 1.41A 1oq5A-4f0jA:
undetectable		 1oq5A-4f0jA:
23.33
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.
4fbl LIPS LIPOLYTIC
ENZYME

(unidentified) 		PF12146
(Hydrolase_4) 		4 HIS A 257
VAL A 258
THR A  59
LEU A 188
 SPD  A 301 (-3.2A)
None
SPD  A 301 (-3.3A)
None
 1.03A 1oq5A-4fblA:
undetectable		 1oq5A-4fblA:
22.88
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.
4fib UNCHARACTERIZED
PROTEIN YDHK

(Bacillus
subtilis) 		PF07563
(DUF1541) 		4 HIS A 194
VAL A 180
THR A  92
LEU A 203
 None
 1.42A 1oq5A-4fibA:
undetectable		 1oq5A-4fibA:
18.53
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.
4fp4 POLYPRENYL
SYNTHETASE

(Pyrobaculum
calidifontis) 		PF00348
(polyprenyl_synt) 		4 HIS A 231
VAL A 232
THR A 186
LEU A 171
 None
 1.32A 1oq5A-4fp4A:
undetectable		 1oq5A-4fp4A:
21.52
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.
4hnh NAD-DEPENDENT
EPIMERASE/DEHYDRATAS
E

(Veillonella
parvula) 		PF13460
(NAD_binding_10) 		4 HIS A  48
VAL A  51
THR A  24
LEU A  18
 None
 1.45A 1oq5A-4hnhA:
undetectable		 1oq5A-4hnhA:
21.32
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.
4ipn 6-PHOSPHO-BETA-GLUCO
SIDASE

(Streptococcus
pneumoniae) 		PF00232
(Glyco_hydro_1) 		4 HIS B 260
VAL B 259
THR B 212
LEU B 289
 None
 1.50A 1oq5A-4ipnB:
undetectable		 1oq5A-4ipnB:
20.12
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.
4ir8 SEDOHEPTULOSE-1,7
BISPHOSPHATASE,
PUTATIVE

(Toxoplasma
gondii) 		PF00316
(FBPase) 		4 HIS A 132
VAL A 152
THR A  22
LEU A  14
 None
 1.46A 1oq5A-4ir8A:
undetectable		 1oq5A-4ir8A:
22.47
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.
4j7b POLO-LIKE KINASE

(Danio rerio) 		PF00069
(Pkinase) 		4 HIS A 214
VAL A 218
THR A 185
LEU A 153
 None
 1.22A 1oq5A-4j7bA:
undetectable		 1oq5A-4j7bA:
22.26
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.
4jif INTEGRIN
BETA-1-BINDING
PROTEIN 1

(Homo sapiens) 		PF10480
(ICAP-1_inte_bdg) 		4 HIS A 131
VAL A 121
THR A 159
LEU A 135
 None
 1.50A 1oq5A-4jifA:
undetectable		 1oq5A-4jifA:
20.54
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.
4nar PUTATIVE URONATE
ISOMERASE

(Thermotoga
maritima) 		PF09861
(DUF2088) 		4 HIS A 180
VAL A 176
THR A 157
LEU A 163
 SO4  A 501 (-4.0A)
None
None
None
 1.50A 1oq5A-4narA:
undetectable		 1oq5A-4narA:
20.45
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.
4ojx 3',5'-CYCLIC-NUCLEOT
IDE
PHOSPHODIESTERASE 1

(Saccharomyces
cerevisiae) 		PF02112
(PDEase_II) 		4 HIS A 130
VAL A 223
THR A 127
LEU A 158
 ZN  A 403 ( 3.2A)
None
None
None
 1.48A 1oq5A-4ojxA:
undetectable		 1oq5A-4ojxA:
21.67
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.
4ol0 TRANSPORTIN-3

(Homo sapiens) 		PF08389
(Xpo1) 		4 HIS B 632
VAL B 626
THR B 578
LEU B 572
 None
 1.40A 1oq5A-4ol0B:
undetectable		 1oq5A-4ol0B:
13.68
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4qk3 CARBONIC ANHYDRASE 2

(Homo sapiens) 		PF00194
(Carb_anhydrase) 		4 HIS A 119
VAL A 143
THR A 200
LEU A 204
 ZN  A 301 (-3.1A)
None
None
None
 0.13A 1oq5A-4qk3A:
44.7		 1oq5A-4qk3A:
95.75
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.
4qlb PROBABLE GLYCOGEN
[STARCH] SYNTHASE

(Caenorhabditis
elegans) 		PF05693
(Glycogen_syn) 		4 HIS A 223
VAL A 276
THR A  62
LEU A 300
 None
 1.09A 1oq5A-4qlbA:
undetectable		 1oq5A-4qlbA:
16.27
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.
4rxe FARNESYL
PYROPHOSPHATE
SYNTHASE

(Trypanosoma
brucei) 		PF00348
(polyprenyl_synt) 		4 HIS A 121
VAL A 124
THR A  42
LEU A 135
 None
 1.43A 1oq5A-4rxeA:
undetectable		 1oq5A-4rxeA:
21.37
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.
5ahu FARNESYL
PYROPHOSPHATE
SYNTHASE
FARNESYL
PYROPHOSPHATE
SYNTHASE, PUTATIVE

(Trypanosoma
brucei) 		PF00348
(polyprenyl_synt)
no annotation 		4 HIS B 121
VAL B 124
THR A  42
LEU B 135
 None
 1.40A 1oq5A-5ahuB:
undetectable		 1oq5A-5ahuB:
19.61
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.
5b3f PHOSPHORIBULOKINASE/
URIDINE KINASE

(Methanospirillum
hungatei) 		PF00485
(PRK) 		4 HIS A 123
VAL A  51
THR A 127
LEU A 133
 None
 1.08A 1oq5A-5b3fA:
undetectable		 1oq5A-5b3fA:
23.01
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.
5dj4 SESTRIN-2

(Homo sapiens) 		PF04636
(PA26) 		4 HIS A 454
VAL A 455
THR A 386
LEU A 416
 LEU  A 501 (-3.8A)
LEU  A 501 ( 4.9A)
LEU  A 501 (-3.0A)
None
 1.10A 1oq5A-5dj4A:
undetectable		 1oq5A-5dj4A:
18.09
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.
5e43 BETA-LACTAMASE

(Streptosporangium
roseum) 		PF13354
(Beta-lactamase2) 		4 HIS A 113
VAL A 109
THR A 119
LEU A 139
 None
ACT  A 302 ( 4.6A)
None
None
 1.50A 1oq5A-5e43A:
undetectable		 1oq5A-5e43A:
19.81
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.
5ee0 OBG-LIKE ATPASE 1

(Oryza sativa) 		PF01926
(MMR_HSR1)
PF06071
(YchF-GTPase_C) 		4 HIS A 124
VAL A  30
THR A 149
LEU A 108
 None
 1.27A 1oq5A-5ee0A:
undetectable		 1oq5A-5ee0A:
20.65
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5ezt CARBONIC ANHYDRASE 2

(Bos taurus) 		PF00194
(Carb_anhydrase) 		4 HIS X 118
VAL X 141
THR X 198
LEU X 202
 ZN  X 301 (-3.1A)
None
None
None
 0.26A 1oq5A-5eztX:
44.3		 1oq5A-5eztX:
80.16
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.
5g5g PUTATIVE XANTHINE
DEHYDROGENASE YAGT
IRON-SULFUR-BINDING
SUBUNIT

(Escherichia
coli) 		PF00111
(Fer2)
PF01799
(Fer2_2) 		4 HIS A 126
VAL A 111
THR A  85
LEU A  92
 None
 1.16A 1oq5A-5g5gA:
undetectable		 1oq5A-5g5gA:
21.85
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.
5hx9 BETA-LACTAMASE

(Burkholderia
vietnamiensis) 		PF13354
(Beta-lactamase2) 		4 HIS A 112
VAL A 108
THR A 118
LEU A 138
 None
EDO  A 302 (-4.0A)
EDO  A 301 ( 4.9A)
None
 1.49A 1oq5A-5hx9A:
undetectable		 1oq5A-5hx9A:
20.39
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.
5i5d INNER MEMBRANE
PROTEIN YEJM

(Salmonella
enterica) 		PF00884
(Sulfatase)
PF11893
(DUF3413) 		4 HIS A 491
VAL A 494
THR A 266
LEU A 263
 None
 1.01A 1oq5A-5i5dA:
undetectable		 1oq5A-5i5dA:
19.24
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.
5imu TAT (TWIN-ARGININE
TRANSLOCATION)
PATHWAY SIGNAL
SEQUENCE CONTAINING
PROTEIN

(Mycobacterium
tuberculosis) 		no annotation 4 HIS A 364
VAL A 357
THR A 399
LEU A 374
 None
 1.34A 1oq5A-5imuA:
undetectable		 1oq5A-5imuA:
21.32
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.
5jki PUTATIVE LIPID
PHOSPHATE
PHOSPHATASE YODM

(Bacillus
subtilis) 		PF01569
(PAP2) 		4 HIS A 171
VAL A 176
THR A  50
LEU A 160
 WO4  A 300 (-2.5A)
None
None
None
 0.98A 1oq5A-5jkiA:
undetectable		 1oq5A-5jkiA:
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.
5msy GLYCOSIDE HYDROLASE

(Bacteroides
thetaiotaomicron) 		PF12904
(Collagen_bind_2)
PF13204
(DUF4038) 		4 HIS A 216
VAL A 146
THR A  61
LEU A  65
 None
None
NH3  A 504 ( 2.8A)
None
 1.21A 1oq5A-5msyA:
undetectable		 1oq5A-5msyA:
18.32
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.
5ods CLATHRIN HEAVY CHAIN
1

(Mus musculus) 		no annotation 4 HIS A 197
VAL A 220
THR A 168
LEU A 183
 None
 1.30A 1oq5A-5odsA:
undetectable		 1oq5A-5odsA:
12.99
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.
5tw7 GMP SYNTHASE
[GLUTAMINE-HYDROLYZI
NG]

(Neisseria
gonorrhoeae) 		PF00117
(GATase)
PF00958
(GMP_synt_C)
PF02540
(NAD_synthase) 		4 HIS A  89
VAL A  59
THR A  68
LEU A   9
 None
 1.49A 1oq5A-5tw7A:
undetectable		 1oq5A-5tw7A:
19.81
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.
5uj6 GLYCOSYL HYDROLASES
FAMILY 2, SUGAR
BINDING DOMAIN
PROTEIN

(Bacteroides
uniformis) 		PF00703
(Glyco_hydro_2)
PF02836
(Glyco_hydro_2_C)
PF02837
(Glyco_hydro_2_N)
PF11721
(Malectin)
PF16355
(DUF4982) 		4 HIS A 186
VAL A 182
THR A 190
LEU A 105
 None
 1.30A 1oq5A-5uj6A:
undetectable		 1oq5A-5uj6A:
16.31
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.
5w3j TUBULIN BETA CHAIN

(Saccharomyces
cerevisiae) 		PF00091
(Tubulin)
PF03953
(Tubulin_C) 		4 HIS B 264
VAL B 258
THR B 166
LEU B 250
 None
 1.32A 1oq5A-5w3jB:
undetectable		 1oq5A-5w3jB:
21.88
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.
5xks THERMOSTABLE
MONOACYLGLYCEROL
LIPASE

(Geobacillus sp.
12AMOR1) 		no annotation 4 HIS A 226
VAL A 227
THR A  30
LEU A 157
 None
 1.06A 1oq5A-5xksA:
undetectable		 1oq5A-5xksA:
12.98
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.
5xww AMPHB

(Streptomyces
nodosus) 		no annotation 4 HIS A  93
VAL A  96
THR A  57
LEU A  83
 None
 1.30A 1oq5A-5xwwA:
undetectable		 1oq5A-5xwwA:
14.29