SIMILAR PATTERNS OF AMINO ACIDS FOR 2ACL_C_REAC503

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.
1akm ORNITHINE
TRANSCARBAMYLASE

(Escherichia
coli) 		PF00185
(OTCace)
PF02729
(OTCace_N) 		5 ALA A  65
ALA A  66
GLN A  69
ASN A  46
ILE A 103
 None
 1.02A 2aclC-1akmA:
undetectable		 2aclC-1akmA:
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.
1dci DIENOYL-COA
ISOMERASE

(Rattus
norvegicus) 		PF00378
(ECH_1) 		5 ILE A 166
ALA A 190
GLN A 188
ALA A 233
ILE A 163
 None
 1.06A 2aclC-1dciA:
undetectable		 2aclC-1dciA:
22.03
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.
1e9y UREASE SUBUNIT BETA

(Helicobacter
pylori) 		PF00449
(Urease_alpha)
PF01979
(Amidohydro_1) 		5 ALA B 185
ALA B 186
ASN B 192
PHE B 139
ILE B 216
 None
 1.17A 2aclC-1e9yB:
0.0		 2aclC-1e9yB:
16.55
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.
1egz ENDOGLUCANASE Z

(Dickeya
chrysanthemi) 		PF00150
(Cellulase) 		5 ALA A 117
GLN A 114
PHE A 113
ALA A 153
ILE A  94
 None
 1.18A 2aclC-1egzA:
undetectable		 2aclC-1egzA:
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.
1i4e CASPASE-8

(Homo sapiens) 		PF00656
(Peptidase_C14) 		5 ASN B2240
PHE B2244
ARG B2248
ALA B2245
ILE B2323
 None
 1.02A 2aclC-1i4eB:
undetectable		 2aclC-1i4eB:
21.63
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.
1k7h ALKALINE PHOSPHATASE

(Pandalus
borealis) 		PF00245
(Alk_phosphatase) 		5 ILE A 350
ALA A  28
GLN A  27
ARG A 137
ILE A 458
 None
 1.13A 2aclC-1k7hA:
undetectable		 2aclC-1k7hA:
19.96
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.
1lfb LIVER TRANSCRIPTION
FACTOR (LFB1)

(Rattus
norvegicus) 		PF00046
(Homeobox) 		5 PHE A  78
ARG A  82
ALA A  79
ILE A  23
CYH A  46
 None
 0.92A 2aclC-1lfbA:
undetectable		 2aclC-1lfbA:
19.82
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) 		5 ILE A 179
ALA A 182
ALA A 183
ALA A 169
ILE A 200
 None
 0.88A 2aclC-1nmoA:
undetectable		 2aclC-1nmoA:
22.61
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.
1ort ORNITHINE
TRANSCARBAMOYLASE

(Pseudomonas
aeruginosa) 		PF00185
(OTCace)
PF02729
(OTCace_N) 		5 ALA A  66
ALA A  67
GLN A  70
ASN A  47
ILE A 104
 None
 0.93A 2aclC-1ortA:
undetectable		 2aclC-1ortA:
20.51
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.
1qdu CASPASE-8
ALPHA-CHAIN

(Homo sapiens) 		PF00656
(Peptidase_C14) 		5 ASN A 169
PHE A 173
ARG A 175
ALA A 174
ILE A 243
 None
 1.07A 2aclC-1qduA:
undetectable		 2aclC-1qduA:
19.05
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.
1ufl NITROGEN REGULATORY
PROTEIN P-II

(Thermus
thermophilus) 		PF00543
(P-II) 		5 ILE A  77
ALA A  76
ALA A  19
ASN A  14
ALA A  23
 None
 1.18A 2aclC-1uflA:
undetectable		 2aclC-1uflA:
20.09
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1uhl RETINOIC ACID
RECEPTOR RXR-BETA

(Homo sapiens) 		PF00104
(Hormone_recep) 		10 ILE A 339
ALA A 342
ALA A 343
GLN A 346
ASN A 377
PHE A 384
ARG A 387
ALA A 398
ILE A 416
CYH A 503
 MEI  A1001 (-3.8A)
MEI  A1001 (-3.1A)
MEI  A1001 (-3.3A)
None
None
MEI  A1001 (-4.5A)
MEI  A1001 (-3.6A)
MEI  A1001 (-3.4A)
None
MEI  A1001 (-4.0A)
 0.83A 2aclC-1uhlA:
30.2		 2aclC-1uhlA:
88.19
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.
1up4 6-PHOSPHO-BETA-GLUCO
SIDASE

(Thermotoga
maritima) 		PF02056
(Glyco_hydro_4)
PF11975
(Glyco_hydro_4C) 		5 ILE A   6
ALA A   4
ALA A  68
ALA A  72
ILE A 119
 None
 1.14A 2aclC-1up4A:
undetectable		 2aclC-1up4A:
19.06
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1xiu RXR-LIKE PROTEIN

(Biomphalaria
glabrata) 		PF00104
(Hormone_recep) 		10 ILE A 242
ALA A 245
ALA A 246
GLN A 249
ASN A 280
PHE A 287
ARG A 290
ALA A 301
ILE A 319
CYH A 406
 9CR  A 201 ( 4.4A)
9CR  A 201 (-3.6A)
9CR  A 201 (-3.6A)
9CR  A 201 (-4.1A)
None
9CR  A 201 (-4.7A)
9CR  A 201 (-2.8A)
9CR  A 201 (-3.4A)
None
9CR  A 201 (-3.6A)
 0.40A 2aclC-1xiuA:
30.9		 2aclC-1xiuA:
81.09
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1xls RETINOIC ACID
RECEPTOR RXR-ALPHA

(Homo sapiens) 		PF00104
(Hormone_recep) 		10 ILE A 268
ALA A 271
ALA A 272
GLN A 275
ASN A 306
PHE A 313
ARG A 316
ALA A 327
ILE A 345
CYH A 432
 9CR  A 801 (-3.9A)
9CR  A 801 (-3.6A)
9CR  A 801 (-3.5A)
9CR  A 801 (-4.7A)
None
9CR  A 801 (-4.3A)
9CR  A 801 (-2.6A)
9CR  A 801 (-3.3A)
9CR  A 801 ( 4.5A)
9CR  A 801 ( 3.7A)
 0.45A 2aclC-1xlsA:
29.8		 2aclC-1xlsA:
100.00
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.
1y0y FRV OPERON PROTEIN
FRVX

(Pyrococcus
horikoshii) 		PF05343
(Peptidase_M42) 		5 ILE A  65
ALA A  66
ALA A 233
ALA A 219
ILE A 348
 None
 1.17A 2aclC-1y0yA:
undetectable		 2aclC-1y0yA:
22.59
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.
1yt5 INORGANIC
POLYPHOSPHATE/ATP-NA
D KINASE

(Thermotoga
maritima) 		PF01513
(NAD_kinase) 		5 ILE A 134
ALA A 148
ASN A 210
ALA A 184
ILE A 224
 None
 1.06A 2aclC-1yt5A:
undetectable		 2aclC-1yt5A:
20.30
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.
1zk7 MERCURIC REDUCTASE

(Pseudomonas
aeruginosa) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		5 ALA A 452
ALA A 451
GLN A 453
ALA A 435
ILE A 418
 None
None
GOL  A3003 ( 3.8A)
None
None
 0.95A 2aclC-1zk7A:
undetectable		 2aclC-1zk7A:
19.28
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.
2bku IMPORTIN BETA-1
SUBUNIT

(Saccharomyces
cerevisiae) 		PF03810
(IBN_N)
PF13513
(HEAT_EZ) 		5 ILE B 119
ALA B 116
ALA B 115
ASN B  99
ALA B 154
 None
 1.11A 2aclC-2bkuB:
undetectable		 2aclC-2bkuB:
14.20
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.
2c4m GLYCOGEN
PHOSPHORYLASE

(Corynebacterium
callunae) 		PF00343
(Phosphorylase) 		5 ILE A 405
ALA A 402
ALA A 330
ASN A 295
ALA A 401
 None
 1.09A 2aclC-2c4mA:
undetectable		 2aclC-2c4mA:
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.
2dg8 PUTATIVE TETR-FAMILY
TRANSCRIPTIONAL
REGULATORY PROTEIN

(Streptomyces
coelicolor) 		PF00440
(TetR_N) 		5 ILE A  35
ALA A  17
ALA A  39
ARG A  63
ALA A  16
 None
 1.15A 2aclC-2dg8A:
undetectable		 2aclC-2dg8A:
24.60
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.
2eo4 150AA LONG
HYPOTHETICAL
HISTIDINE TRIAD
NUCLEOTIDE-BINDING
PROTEIN

(Sulfurisphaera
tokodaii) 		PF01230
(HIT) 		5 ILE A  39
ALA A  23
ALA A  24
ARG A   9
ILE A  92
 None
None
None
None
PO4  A 202 ( 4.6A)
 1.16A 2aclC-2eo4A:
undetectable		 2aclC-2eo4A:
23.53
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2gl8 RETINOIC ACID
RECEPTOR RXR-GAMMA

(Homo sapiens) 		PF00104
(Hormone_recep) 		5 PHE A  92
ARG A  95
ALA A 106
ILE A 124
CYH A 211
 None
 0.83A 2aclC-2gl8A:
27.9		 2aclC-2gl8A:
85.60
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.
2hnh DNA POLYMERASE III
ALPHA SUBUNIT

(Escherichia
coli) 		PF02811
(PHP)
PF07733
(DNA_pol3_alpha)
PF14579
(HHH_6) 		5 ILE A 564
ALA A 785
ALA A 568
PHE A 782
ALA A 784
 None
 1.16A 2aclC-2hnhA:
undetectable		 2aclC-2hnhA:
13.38
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.
2isj BLUB

(Sinorhizobium
meliloti) 		PF00881
(Nitroreductase) 		5 ILE A 168
ALA A  91
ARG A 104
ALA A  92
ILE A 111
 FMN  A 502 (-4.5A)
None
None
None
None
 1.12A 2aclC-2isjA:
undetectable		 2aclC-2isjA:
23.74
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.
2jjf L-LYSINE EPSILON
AMINOTRANSFERASE

(Mycobacterium
tuberculosis) 		PF00202
(Aminotran_3) 		5 ILE A 232
ALA A 233
ALA A 266
ALA A 139
ILE A 196
 None
 1.18A 2aclC-2jjfA:
undetectable		 2aclC-2jjfA:
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.
2jss CHIMERA OF HISTONE
H2B.1 AND HISTONE
H2A.Z

(Saccharomyces
cerevisiae) 		PF00125
(Histone)
PF16211
(Histone_H2A_C) 		5 ILE A  62
ALA A  45
ALA A  42
ALA A  49
ILE A 131
 None
 1.17A 2aclC-2jssA:
undetectable		 2aclC-2jssA:
25.83
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.
2ksm MYCOBACTERIUM
TUBERCULOSIS
RV0899/MT0922/OMPATB

(Mycobacterium
tuberculosis) 		PF04972
(BON) 		5 ALA A 104
ALA A 105
PHE A  97
ALA A 101
ILE A  84
 None
 1.17A 2aclC-2ksmA:
undetectable		 2aclC-2ksmA:
20.16
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.
2p0r CALPAIN-9

(Homo sapiens) 		PF00648
(Peptidase_C2) 		5 ILE A 103
ALA A 101
ASN A 109
ALA A 192
ILE A 117
 None
 1.11A 2aclC-2p0rA:
undetectable		 2aclC-2p0rA:
22.64
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.
2p88 MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME
FAMILY PROTEIN

(Bacillus cereus) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 ILE A 175
ALA A 177
ASN A 213
ALA A 146
ILE A 217
 None
 1.13A 2aclC-2p88A:
undetectable		 2aclC-2p88A:
21.26
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.
2poz PUTATIVE DEHYDRATASE

(Mesorhizobium
japonicum) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 ILE A  96
ALA A  95
ASN A   9
ALA A  37
ILE A  61
 None
 1.18A 2aclC-2pozA:
undetectable		 2aclC-2pozA:
20.85
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2q60 RETINOID X RECEPTOR

(Polyandrocarpa
misakiensis) 		PF00104
(Hormone_recep) 		6 ASN A 181
PHE A 188
ARG A 191
ALA A 202
ILE A 220
CYH A 307
 None
 0.70A 2aclC-2q60A:
28.0		 2aclC-2q60A:
71.81
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.
2qm1 GLUCOKINASE

(Enterococcus
faecalis) 		PF00480
(ROK) 		5 ILE A   6
ALA A 316
GLN A 318
ALA A 110
ILE A  55
 None
 1.16A 2aclC-2qm1A:
undetectable		 2aclC-2qm1A:
24.32
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.
2vhh CG3027-PA

(Drosophila
melanogaster) 		PF00795
(CN_hydrolase) 		5 ILE A 105
ALA A 108
ALA A 109
ASN A 160
ILE A 185
 None
 1.08A 2aclC-2vhhA:
undetectable		 2aclC-2vhhA:
20.30
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.
2vre DELTA(3,5)-DELTA(2,4
)-DIENOYL-COA
ISOMERASE

(Homo sapiens) 		PF00378
(ECH_1) 		5 ALA A 165
ALA A 162
GLN A 163
ALA A 208
ILE A 138
 None
 1.07A 2aclC-2vreA:
undetectable		 2aclC-2vreA:
21.12
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.
3aoe GLUTAMATE
DEHYDROGENASE

(Thermus
thermophilus) 		PF00208
(ELFV_dehydrog)
PF02812
(ELFV_dehydrog_N) 		5 ILE A 348
ALA A 405
ASN A 385
ALA A 404
ILE A 204
 None
 1.18A 2aclC-3aoeA:
undetectable		 2aclC-3aoeA:
19.46
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.
3cty THIOREDOXIN
REDUCTASE

(Thermoplasma
acidophilum) 		PF07992
(Pyr_redox_2) 		5 ILE A 297
ALA A 300
PHE A  78
ALA A  27
ILE A  69
 FAD  A1000 (-3.7A)
FAD  A1000 ( 4.0A)
None
FAD  A1000 (-3.4A)
None
 1.16A 2aclC-3ctyA:
undetectable		 2aclC-3ctyA:
18.35
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.
3do5 HOMOSERINE
DEHYDROGENASE

(Archaeoglobus
fulgidus) 		PF00742
(Homoserine_dh)
PF03447
(NAD_binding_3) 		5 ALA A 248
GLN A 246
PHE A 245
ALA A 249
ILE A 237
 None
 1.18A 2aclC-3do5A:
undetectable		 2aclC-3do5A:
22.09
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3dzu RETINOIC ACID
RECEPTOR RXR-ALPHA

(Homo sapiens) 		PF00104
(Hormone_recep)
PF00105
(zf-C4) 		8 ALA A 271
ALA A 272
GLN A 275
ASN A 306
PHE A 313
ARG A 316
ILE A 345
CYH A 432
 9CR  A7223 (-3.5A)
9CR  A7223 (-4.2A)
9CR  A7223 (-4.6A)
9CR  A7223 (-3.9A)
9CR  A7223 (-4.5A)
9CR  A7223 (-3.7A)
9CR  A7223 ( 4.9A)
9CR  A7223 (-3.8A)
 0.77A 2aclC-3dzuA:
30.1		 2aclC-3dzuA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3dzu RETINOIC ACID
RECEPTOR RXR-ALPHA

(Homo sapiens) 		PF00104
(Hormone_recep)
PF00105
(zf-C4) 		9 ILE A 268
ALA A 271
ALA A 272
GLN A 275
PHE A 313
ARG A 316
ALA A 327
ILE A 345
CYH A 432
 9CR  A7223 (-3.9A)
9CR  A7223 (-3.5A)
9CR  A7223 (-4.2A)
9CR  A7223 (-4.6A)
9CR  A7223 (-4.5A)
9CR  A7223 (-3.7A)
9CR  A7223 ( 4.7A)
9CR  A7223 ( 4.9A)
9CR  A7223 (-3.8A)
 0.81A 2aclC-3dzuA:
30.1		 2aclC-3dzuA:
100.00
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.
3e82 PUTATIVE
OXIDOREDUCTASE

(Klebsiella
pneumoniae) 		PF01408
(GFO_IDH_MocA)
PF02894
(GFO_IDH_MocA_C) 		5 ALA A 340
ALA A 341
GLN A 351
ASN A 209
ILE A 235
 None
 1.07A 2aclC-3e82A:
undetectable		 2aclC-3e82A:
20.66
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.
3fi8 CHOLINE KINASE

(Plasmodium
falciparum) 		PF01633
(Choline_kinase) 		5 ILE A 323
ALA A 319
ALA A 385
GLN A 384
ALA A 316
 OPE  A 442 ( 4.8A)
None
OPE  A 442 ( 4.0A)
None
None
 1.13A 2aclC-3fi8A:
undetectable		 2aclC-3fi8A:
18.75
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.
3g7k 3-METHYLITACONATE
ISOMERASE

(Eubacterium
barkeri) 		PF04303
(PrpF) 		5 ALA A 172
ALA A 202
PHE A 261
ALA A 173
ILE A  99
 None
 1.18A 2aclC-3g7kA:
undetectable		 2aclC-3g7kA:
20.25
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.
3h7a SHORT CHAIN
DEHYDROGENASE

(Rhodopseudomonas
palustris) 		PF00106
(adh_short) 		5 ILE A  21
ALA A  22
ALA A  19
ALA A  34
ILE A 183
 ILE  A  21 ( 0.6A)
ALA  A  22 ( 0.0A)
ALA  A  19 ( 0.0A)
ALA  A  34 ( 0.0A)
ILE  A 183 ( 0.7A)
 1.07A 2aclC-3h7aA:
undetectable		 2aclC-3h7aA:
23.76
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.
3ic6 PUTATIVE METHYLASE
FAMILY PROTEIN

(Neisseria
gonorrhoeae) 		PF00588
(SpoU_methylase) 		5 ILE A  28
ALA A  31
ALA A  32
ASN A  89
ILE A  92
 None
 1.05A 2aclC-3ic6A:
undetectable		 2aclC-3ic6A:
21.13
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.
3il3 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 3

(Haemophilus
influenzae) 		PF08541
(ACP_syn_III_C)
PF08545
(ACP_syn_III) 		5 ILE A 137
ALA A  91
GLN A  93
ALA A  52
ILE A 165
 None
 0.95A 2aclC-3il3A:
undetectable		 2aclC-3il3A:
25.00
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.
3j0l RIBOSOMAL PROTEIN
S14

(Oryctolagus
cuniculus) 		PF00411
(Ribosomal_S11) 		5 ILE K  42
ALA K  77
ALA K  74
GLN K  76
ILE K  95
 None
 1.10A 2aclC-3j0lK:
undetectable		 2aclC-3j0lK:
24.14
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.
3m5w TRYPTOPHANYL-TRNA
SYNTHETASE

(Campylobacter
jejuni) 		PF00579
(tRNA-synt_1b) 		5 ALA A 129
ALA A 130
PHE A 168
ALA A 153
ILE A 317
 None
 1.18A 2aclC-3m5wA:
undetectable		 2aclC-3m5wA:
24.23
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.
3nvt 3-DEOXY-D-ARABINO-HE
PTULOSONATE
7-PHOSPHATE SYNTHASE

(Listeria
monocytogenes) 		PF00793
(DAHP_synth_1)
PF01817
(CM_2) 		5 ILE A 248
ALA A 245
ALA A 244
ASN A 211
ILE A 195
 None
 1.04A 2aclC-3nvtA:
undetectable		 2aclC-3nvtA:
22.63
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.
3nvt 3-DEOXY-D-ARABINO-HE
PTULOSONATE
7-PHOSPHATE SYNTHASE

(Listeria
monocytogenes) 		PF00793
(DAHP_synth_1)
PF01817
(CM_2) 		5 ILE A 248
ALA A 245
ALA A 244
ASN A 214
ILE A 195
 None
 1.13A 2aclC-3nvtA:
undetectable		 2aclC-3nvtA:
22.63
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.
3pm9 PUTATIVE
OXIDOREDUCTASE

(Rhodopseudomonas
palustris) 		PF01565
(FAD_binding_4)
PF02913
(FAD-oxidase_C) 		5 ALA A 332
GLN A 329
PHE A 234
ALA A 324
ILE A 340
 None
 1.05A 2aclC-3pm9A:
undetectable		 2aclC-3pm9A:
20.00
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.
3qfe PUTATIVE
DIHYDRODIPICOLINATE
SYNTHASE FAMILY
PROTEIN

(Coccidioides
immitis) 		PF00701
(DHDPS) 		5 ALA A 270
ALA A 265
ASN A  51
ALA A 278
ILE A  47
 None
 1.15A 2aclC-3qfeA:
undetectable		 2aclC-3qfeA:
22.12
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.
3qgk UREASE SUBUNIT BETA
2

(Helicobacter
mustelae) 		PF00449
(Urease_alpha)
PF01979
(Amidohydro_1) 		5 ALA C 184
ALA C 185
ASN C 191
PHE C 138
ILE C 215
 None
 1.12A 2aclC-3qgkC:
undetectable		 2aclC-3qgkC:
18.28
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.
3qr8 BASEPLATE ASSEMBLY
PROTEIN V

(Escherichia
virus P2) 		PF04717
(Phage_base_V) 		5 ILE A  69
ALA A  71
ALA A  79
ILE A  23
CYH A  33
 None
 1.09A 2aclC-3qr8A:
undetectable		 2aclC-3qr8A:
23.53
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.
3sll PROBABLE ENOYL-COA
HYDRATASE/ISOMERASE

(Mycobacteroides
abscessus) 		PF00378
(ECH_1) 		5 ILE A 109
ALA A 133
GLN A 131
ALA A 176
ILE A 106
 None
 1.09A 2aclC-3sllA:
undetectable		 2aclC-3sllA:
22.18
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.
3wc3 ENDO-1,
4-BETA-GLUCANASE

(Eisenia fetida) 		PF00759
(Glyco_hydro_9) 		5 ALA A 178
ALA A 177
PHE A  87
ALA A  86
ILE A 332
 None
 1.04A 2aclC-3wc3A:
undetectable		 2aclC-3wc3A:
18.35
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.
4b7x PROBABLE
OXIDOREDUCTASE

(Pseudomonas
aeruginosa) 		PF00107
(ADH_zinc_N)
PF16884
(ADH_N_2) 		5 ILE A 178
ALA A 179
ALA A 157
ILE A 217
CYH A 213
 None
NAP  A 400 (-3.7A)
None
None
None
 1.06A 2aclC-4b7xA:
undetectable		 2aclC-4b7xA:
21.79
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.
4dix PLECTIN-RELATED
PROTEIN

(Arabidopsis
thaliana) 		PF16709
(SCAB-IgPH) 		5 ILE A 457
ALA A 458
ALA A 444
GLN A 443
ILE A 411
 None
 1.08A 2aclC-4dixA:
undetectable		 2aclC-4dixA:
22.55
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.
4dut NUCLEOSIDE
DIPHOSPHATE KINASE

(Burkholderia
thailandensis) 		PF00334
(NDK) 		6 ILE A  23
ALA A 115
ALA A  14
ASN A  18
PHE A 107
ALA A 108
 None
 1.39A 2aclC-4dutA:
undetectable		 2aclC-4dutA:
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.
4f62 GERANYLTRANSTRANSFER
ASE

(Marinomonas sp.
MED121) 		PF00348
(polyprenyl_synt) 		5 ALA A 211
ALA A 267
GLN A 270
ALA A 207
ILE A  46
 None
None
None
None
GOL  A 402 (-4.3A)
 1.14A 2aclC-4f62A:
4.1		 2aclC-4f62A:
23.38
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.
4g0o PROTEIN ARGONAUTE 5

(Arabidopsis
thaliana) 		PF02171
(Piwi) 		5 ILE A 629
ALA A 633
ALA A 611
ILE A 653
CYH A 657
 None
 1.06A 2aclC-4g0oA:
undetectable		 2aclC-4g0oA:
21.55
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.
4g0y PROTEIN ARGONAUTE 1

(Arabidopsis
thaliana) 		PF02171
(Piwi) 		5 ILE A 610
ALA A 650
GLN A 654
ILE A 704
CYH A 698
 None
 1.10A 2aclC-4g0yA:
undetectable		 2aclC-4g0yA:
20.00
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.
4ifd EXOSOME COMPLEX
COMPONENT RRP43

(Saccharomyces
cerevisiae) 		PF01138
(RNase_PH) 		5 ILE C 291
ALA C 352
PHE C 293
ALA C 351
ILE C 394
 None
 1.15A 2aclC-4ifdC:
undetectable		 2aclC-4ifdC:
20.72
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4j5x RETINOIC ACID
RECEPTOR RXR-ALPHA,
NUCLEAR RECEPTOR
COACTIVATOR 1

(Homo sapiens) 		no annotation 10 ILE D 268
ALA D 271
ALA D 272
GLN D 275
ASN D 306
PHE D 313
ARG D 316
ALA D 327
ILE D 345
CYH D 432
 None
 0.77A 2aclC-4j5xD:
28.5		 2aclC-4j5xD:
100.00
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.
4jqo ORNITHINE
CARBAMOYLTRANSFERASE

(Vibrio
vulnificus) 		PF00185
(OTCace)
PF02729
(OTCace_N) 		5 ALA A  67
ALA A  68
GLN A  71
ASN A  48
ILE A 105
 None
 1.05A 2aclC-4jqoA:
undetectable		 2aclC-4jqoA:
22.22
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.
4nn1 TRANSCRIPTIONAL
REGULATOR

(Mycobacterium
tuberculosis) 		PF00440
(TetR_N) 		5 ILE A  12
ALA A  15
ALA A  16
GLN A  19
ALA A  35
 None
 0.53A 2aclC-4nn1A:
undetectable		 2aclC-4nn1A:
26.39
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.
4pn3 3-HYDROXYACYL-COA
DEHYDROGENASE

(Brucella
melitensis) 		PF00106
(adh_short) 		5 ILE A  80
ALA A  73
GLN A  56
ALA A  72
ILE A 143
 None
 1.11A 2aclC-4pn3A:
undetectable		 2aclC-4pn3A:
23.40
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.
4pq9 BETA-1,3-GLUCANASE

(Mycobacterium
marinum) 		PF00722
(Glyco_hydro_16) 		5 ILE A  90
ALA A 101
ALA A  92
ARG A  55
ILE A 120
 None
 1.14A 2aclC-4pq9A:
undetectable		 2aclC-4pq9A:
20.14
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.
4pue ENDO-1,4-BETA-XYLANA
SE

(Geobacillus
stearothermophilus) 		PF00331
(Glyco_hydro_10) 		5 ALA A 188
ASN A 158
PHE A 185
ALA A 187
ILE A 231
 None
XYP  A 403 (-3.2A)
None
None
None
 1.17A 2aclC-4pueA:
undetectable		 2aclC-4pueA:
21.62
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.
4qji PHOSPHOPANTOTHENOYLC
YSTEINE
DECARBOXYLASE/PHOSPH
OPANTOTHENATE--CYSTE
INE LIGASE

(Mycolicibacterium
smegmatis) 		PF04127
(DFP) 		5 ALA A 277
ALA A 196
PHE A 332
ALA A 278
ILE A 405
 CTP  A 500 (-4.8A)
None
None
None
None
 1.05A 2aclC-4qjiA:
undetectable		 2aclC-4qjiA:
23.08
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.
4tv6 2-DEHYDRO-3-DEOXYGLU
CARATE ALDOLASE

(Staphylococcus
aureus) 		PF03328
(HpcH_HpaI) 		5 ILE A  33
ALA A  34
ALA A  35
ALA A  65
ILE A 241
 None
 1.14A 2aclC-4tv6A:
undetectable		 2aclC-4tv6A:
21.51
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.
4uie SURFACE LAYER
PROTEIN

(Geobacillus
stearothermophilus) 		no annotation 5 ILE A1069
ALA A1025
ALA A1026
ALA A1032
ILE A1093
 None
 1.16A 2aclC-4uieA:
undetectable		 2aclC-4uieA:
19.94
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.
5b0v MATRIX PROTEIN VP40

(Marburg
marburgvirus) 		PF07447
(VP40) 		5 ILE A 228
ALA A 227
PHE A 256
ALA A 213
ILE A 204
 None
 1.11A 2aclC-5b0vA:
undetectable		 2aclC-5b0vA:
22.74
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.
5dle PTS SYSTEM,
FRUCTOSE-SPECIFIC
IIABC COMPONENT

(Borreliella
burgdorferi) 		PF02302
(PTS_IIB) 		5 ALA A 182
ALA A 183
ASN A 209
ALA A 225
ILE A 205
 None
 1.07A 2aclC-5dleA:
undetectable		 2aclC-5dleA:
17.50
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.
5fq6 SUSC/RAGA FAMILY
TONB-LINKED OUTER
MEMBRANE PROTEIN

(Bacteroides
thetaiotaomicron) 		PF00593
(TonB_dep_Rec)
PF07715
(Plug) 		5 ILE B 777
ALA B 769
GLN B 767
ASN B 780
ILE B 855
 None
 1.13A 2aclC-5fq6B:
undetectable		 2aclC-5fq6B:
13.09
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.
5hf4 DISKS LARGE HOMOLOG
4

(Rattus
norvegicus) 		PF00595
(PDZ) 		6 ALA A 375
ALA A 378
GLN A 374
ASN A 363
ALA A 370
ILE A 314
 None
 1.47A 2aclC-5hf4A:
undetectable		 2aclC-5hf4A:
18.26
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.
5iwx 2-C-METHYL-D-ERYTHRI
TOL
2,4-CYCLODIPHOSPHATE
SYNTHASE

(Bacillus
subtilis) 		PF02542
(YgbB) 		5 ILE A 147
ALA A 148
ALA A 149
GLN A 150
ILE A  26
 None
 0.94A 2aclC-5iwxA:
undetectable		 2aclC-5iwxA:
20.25
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.
5j6f 3-DEOXY-D-ARABINO-HE
PTULOSONATE
7-PHOSPHATE
SYNTHASE, CHORISMATE
MUTASE-ISOZYME 3

(Geobacillus sp.
GHH01) 		PF00793
(DAHP_synth_1)
PF01817
(CM_2) 		5 ILE A 248
ALA A 245
ALA A 244
ASN A 211
ILE A 195
 None
 1.06A 2aclC-5j6fA:
undetectable		 2aclC-5j6fA:
22.96
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.
5j6f 3-DEOXY-D-ARABINO-HE
PTULOSONATE
7-PHOSPHATE
SYNTHASE, CHORISMATE
MUTASE-ISOZYME 3

(Geobacillus sp.
GHH01) 		PF00793
(DAHP_synth_1)
PF01817
(CM_2) 		5 ILE A 248
ALA A 245
ALA A 244
ASN A 214
ILE A 195
 None
 1.12A 2aclC-5j6fA:
undetectable		 2aclC-5j6fA:
22.96
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.
5jbw 3-HYDROXYBUTYRYL-COA
DEHYDRATASE

(Myxococcus
xanthus) 		PF00378
(ECH_1) 		5 ILE A 102
ALA A 101
ALA A 100
ALA A 190
ILE A 166
 None
 1.02A 2aclC-5jbwA:
undetectable		 2aclC-5jbwA:
26.32
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.
5l39 RMM MICROCOMPARTMENT
SHELL PROTEIN
MSM0275

(Mycolicibacterium
smegmatis) 		PF00936
(BMC) 		5 ALA A 188
ALA A 191
GLN A 187
ALA A 160
ILE A  10
 None
 1.18A 2aclC-5l39A:
undetectable		 2aclC-5l39A:
21.29
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.
5l6m RIBONUCLEASE VAPC

(Caulobacter
vibrioides) 		PF01850
(PIN) 		5 ILE B  82
ALA B 100
ALA B  99
GLN B 101
ALA B  75
 None
 1.09A 2aclC-5l6mB:
undetectable		 2aclC-5l6mB:
18.91
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.
5maw FLAGELLAR PROTEIN
FLIS

(Bacillus
subtilis) 		no annotation 5 ILE E  35
ALA E  39
ALA E  38
GLN E  40
ILE E  60
 None
 1.08A 2aclC-5mawE:
undetectable		 2aclC-5mawE:
25.83
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.
5mnw GUANYLATE CYCLASE
SOLUBLE SUBUNIT
BETA-1

(Homo sapiens) 		no annotation 5 ILE A  25
ALA A  54
ALA A  29
ALA A  53
ILE A  14
 None
 1.04A 2aclC-5mnwA:
undetectable		 2aclC-5mnwA:
17.03
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.
5n0g PRECORRIN-8X
METHYLMUTASE

(Rhodobacter
capsulatus) 		no annotation 5 ILE A 196
ALA A  44
ALA A  43
ASN A 202
ILE A 160
 None
None
8F5  A 301 ( 4.1A)
8F5  A 301 (-3.8A)
None
 1.07A 2aclC-5n0gA:
undetectable		 2aclC-5n0gA:
18.03
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.
5ocm NAD_GLY3P_DH,
NAD-DEPENDENT
GLYCEROL-3-PHOSPHATE
DEHYDROGENASE

(Streptosporangium
roseum) 		no annotation 5 ILE A 209
ALA A 205
ASN A 182
ALA A 202
ILE A 176
 None
 1.17A 2aclC-5ocmA:
undetectable		 2aclC-5ocmA:
18.66
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.
5ojl IMINE REDUCTASE

(Aspergillus
terreus) 		no annotation 6 ILE A 137
ALA A 135
ALA A 125
ALA A 132
ILE A  68
CYH A  70
 None
None
9X5  A 301 ( 4.8A)
None
None
None
 1.26A 2aclC-5ojlA:
undetectable		 2aclC-5ojlA:
13.22
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.
5opt 40S RIBOSOMAL
PROTEIN S21,
PUTATIVE

(Trypanosoma
cruzi) 		no annotation 5 ILE g  41
ALA g  40
GLN g  38
PHE g  57
ILE g  83
 None
 1.13A 2aclC-5optg:
undetectable		 2aclC-5optg:
19.85
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.
5t5i TUNGSTEN
FORMYLMETHANOFURAN
DEHYDROGENASE
SUBUNIT FWDD

(Methanothermobacter
wolfeii) 		PF01568
(Molydop_binding) 		6 ILE D  78
ALA D  30
ALA D  31
ASN D  50
ALA D  29
ILE D 107
 None
 1.47A 2aclC-5t5iD:
undetectable		 2aclC-5t5iD:
19.23
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.
5txr 5-AMINOLEVULINATE
SYNTHASE,
MITOCHONDRIAL

(Saccharomyces
cerevisiae) 		no annotation 5 ILE B 331
ALA B 347
ALA B 348
ALA B 168
ILE B 264
 None
 1.05A 2aclC-5txrB:
undetectable		 2aclC-5txrB:
15.74
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5uan RETINOIC ACID
RECEPTOR RXR-ALPHA

(Homo sapiens) 		no annotation 6 ALA A 271
ALA A 272
PHE A 313
ARG A 316
ALA A 327
ILE A 428
 9CR  A 503 (-3.5A)
9CR  A 503 (-3.5A)
9CR  A 503 (-4.7A)
9CR  A 503 (-3.0A)
9CR  A 503 (-3.4A)
None
 1.38A 2aclC-5uanA:
29.8		 2aclC-5uanA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5uan RETINOIC ACID
RECEPTOR RXR-ALPHA

(Homo sapiens) 		no annotation 10 ILE A 268
ALA A 271
ALA A 272
GLN A 275
ASN A 306
PHE A 313
ARG A 316
ALA A 327
ILE A 345
CYH A 432
 9CR  A 503 (-4.0A)
9CR  A 503 (-3.5A)
9CR  A 503 (-3.5A)
9CR  A 503 (-3.8A)
None
9CR  A 503 (-4.7A)
9CR  A 503 (-3.0A)
9CR  A 503 (-3.4A)
None
9CR  A 503 (-3.3A)
 0.62A 2aclC-5uanA:
29.8		 2aclC-5uanA:
100.00
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.
5un0 PROTEASOME ASSEMBLY
CHAPERONE 2 (PAC2)
HOMOLOGUE RV2125

(Mycobacterium
tuberculosis) 		PF09754
(PAC2) 		5 ILE 1 128
ALA 1 185
ALA 1 148
ILE 1 170
CYH 1 111
 None
 1.16A 2aclC-5un01:
undetectable		 2aclC-5un01:
24.63
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.
5wqw N-ACETYLGLUCOSAMINID
ASE

(Clostridium
perfringens) 		PF01832
(Glucosaminidase) 		5 ALA A1060
ALA A1059
PHE A 951
ALA A 954
ILE A1107
 None
EDO  A1202 (-4.0A)
None
None
None
 1.14A 2aclC-5wqwA:
undetectable		 2aclC-5wqwA:
21.63
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.
6cbo C-6'
AMINOTRANSFERASE

(Micromonospora
echinospora) 		no annotation 5 ILE A  45
ALA A  34
PHE A 353
ALA A 352
ILE A 365
 None
 0.91A 2aclC-6cboA:
undetectable		 2aclC-6cboA:
17.96
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.
6d95 -

(-) 		no annotation 5 ILE A 129
ALA A 132
ALA A 133
ALA A 266
ILE A 180
 None
 0.90A 2aclC-6d95A:
undetectable		 2aclC-6d95A:
undetectable
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.
6et9 ACETYL-COA
ACETYLTRANSFERASE
THIOLASE

(Methanothermococcus
thermolithotrophicus) 		no annotation 5 ILE A  26
ALA A  29
ALA A 215
GLN A  11
ILE A  63
 None
 1.10A 2aclC-6et9A:
undetectable		 2aclC-6et9A:
20.30
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.
6f4f GLUTATHIONE
TRANSFERASE

(Trametes
versicolor) 		no annotation 5 ILE A  88
ALA A  28
ALA A  30
ALA A  95
ILE A  78
 None
 1.18A 2aclC-6f4fA:
undetectable		 2aclC-6f4fA:
15.45
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.
6gbu F-BAR AND DOUBLE SH3
DOMAINS PROTEIN 2

(Homo sapiens) 		no annotation 5 ILE A  28
ALA A   8
ALA A  26
ASN A  47
ILE A  50
 None
 1.15A 2aclC-6gbuA:
undetectable		 2aclC-6gbuA:
14.66
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.
6gdg TRXA,ADENOSINE
RECEPTOR A2A

(Escherichia
coli;
Homo sapiens) 		no annotation 5 ILE A 200
ALA A 203
ALA A 204
GLN A 207
ILE A 238
 None
 0.97A 2aclC-6gdgA:
undetectable		 2aclC-6gdgA:
14.16