SIMILAR PATTERNS OF AMINO ACIDS FOR 2ZW9_B_SAMB801

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.
1b1y PROTEIN
(BETA-AMYLASE)

(Hordeum vulgare) 		PF01373
(Glyco_hydro_14) 		5 GLN A 403
GLY A   7
GLY A 405
LEU A 443
ASN A 442
 None
 1.23A 2zw9B-1b1yA:
2.1		 2zw9B-1b1yA:
21.65
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.
1clx XYLANASE A

(Cellvibrio
japonicus) 		PF00331
(Glyco_hydro_10) 		5 GLY A 275
ASP A 277
LEU A 251
ASP A 256
ASN A 258
 None
None
None
CA  A 348 (-2.3A)
None
 1.15A 2zw9B-1clxA:
undetectable		 2zw9B-1clxA:
18.90
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.
1f0i PHOSPHOLIPASE D

(Streptomyces
sp. PMF) 		PF13091
(PLDc_2) 		5 THR A 221
GLY A 274
GLY A 272
ASP A 473
ASP A 279
 None
 1.22A 2zw9B-1f0iA:
undetectable		 2zw9B-1f0iA:
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.
1fw8 PHOSPHOGLYCERATE
KINASE

(Saccharomyces
cerevisiae) 		PF00162
(PGK) 		5 THR A 304
GLY A 322
GLY A 298
ASP A 367
ASN A 369
 None
None
None
GOL  A 973 (-3.6A)
None
 0.99A 2zw9B-1fw8A:
undetectable		 2zw9B-1fw8A:
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.
1h76 SEROTRANSFERRIN

(Sus scrofa) 		PF00405
(Transferrin) 		5 GLY A 120
GLY A 122
LEU A  65
ASN A 185
TYR A 192
 None
None
None
None
CO3  A 700 ( 3.8A)
 1.13A 2zw9B-1h76A:
undetectable		 2zw9B-1h76A:
21.99
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.
1hww ALPHA-MANNOSIDASE II

(Drosophila
melanogaster) 		PF01074
(Glyco_hydro_38)
PF07748
(Glyco_hydro_38C)
PF09261
(Alpha-mann_mid) 		5 GLY A 533
GLY A 535
ASP A 538
LEU A 779
TYR A 424
 None
 1.22A 2zw9B-1hwwA:
undetectable		 2zw9B-1hwwA:
21.28
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.
1nba N-CARBAMOYLSARCOSINE
AMIDOHYDROLASE

(Arthrobacter
sp.) 		PF00857
(Isochorismatase) 		5 THR A  57
GLY A 171
GLY A 200
ASP A 201
ASN A  79
 None
 1.21A 2zw9B-1nbaA:
3.0		 2zw9B-1nbaA:
19.22
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.
1nnv HYPOTHETICAL PROTEIN
HI1450

(Haemophilus
influenzae) 		PF04269
(DUF440) 		5 GLN A  40
GLY A  75
GLY A  45
ASP A  33
GLU A  48
 None
 1.22A 2zw9B-1nnvA:
undetectable		 2zw9B-1nnvA:
9.34
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.
1nxz HYPOTHETICAL PROTEIN
HI0303

(Haemophilus
influenzae) 		PF04452
(Methyltrans_RNA) 		5 THR A  95
GLY A 195
LEU A 192
LEU A 156
GLU A 197
 None
 1.21A 2zw9B-1nxzA:
undetectable		 2zw9B-1nxzA:
17.55
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.
1pw5 NAGD PROTEIN,
PUTATIVE

(Thermotoga
maritima) 		PF13242
(Hydrolase_like)
PF13344
(Hydrolase_6) 		5 GLY A 120
ASP A 161
LEU A 125
LEU A  92
TYR A 143
 None
 1.20A 2zw9B-1pw5A:
2.5		 2zw9B-1pw5A:
18.41
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.
1rvk ISOMERASE/LACTONIZIN
G ENZYME

(Agrobacterium
fabrum) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 GLY A 220
GLY A 222
LEU A 246
TYR A 211
MET A 235
 None
 1.24A 2zw9B-1rvkA:
undetectable		 2zw9B-1rvkA:
19.77
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.
1szq 2-METHYLCITRATE
DEHYDRATASE

(Escherichia
coli) 		PF03972
(MmgE_PrpD) 		5 GLY A 427
GLY A 435
ASP A 434
ASP A 103
LEU A 282
 None
 1.24A 2zw9B-1szqA:
undetectable		 2zw9B-1szqA:
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.
1u8x MALTOSE-6'-PHOSPHATE
GLUCOSIDASE

(Bacillus
subtilis) 		PF02056
(Glyco_hydro_4)
PF11975
(Glyco_hydro_4C) 		5 GLN X 381
THR X 207
GLY X 199
GLY X 204
ASN X 351
 None
 1.10A 2zw9B-1u8xX:
3.4		 2zw9B-1u8xX:
22.35
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.
1v43 SUGAR-BINDING
TRANSPORT
ATP-BINDING PROTEIN

(Pyrococcus
horikoshii) 		PF00005
(ABC_tran)
PF08402
(TOBE_2) 		5 THR A  26
GLY A  50
LEU A  15
ASN A  32
GLU A  62
 None
 1.13A 2zw9B-1v43A:
undetectable		 2zw9B-1v43A:
20.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1xe7 HYPOTHETICAL 22.5
KDA PROTEIN IN
TUB1-CPR3 INTERGENIC
REGION

(Saccharomyces
cerevisiae) 		PF06172
(Cupin_5) 		5 GLY A 109
GLY A 160
ASP A 158
LEU A 151
LEU A 106
 None
 1.18A 2zw9B-1xe7A:
undetectable		 2zw9B-1xe7A:
15.52
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.
1xfu CALMODULIN-SENSITIVE
ADENYLATE CYCLASE

(Bacillus
anthracis) 		PF03497
(Anthrax_toxA)
PF07737
(ATLF) 		5 GLY A 578
LEU A 348
LEU A 557
ASN A 561
GLU A 580
 None
 1.22A 2zw9B-1xfuA:
undetectable		 2zw9B-1xfuA:
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.
2d4e 5-CARBOXYMETHYL-2-HY
DROXYMUCONATE
SEMIALDEHYDE
DEHYDROGENASE

(Thermus
thermophilus) 		PF00171
(Aldedh) 		5 THR A 248
GLY A 476
GLY A 482
ASP A 483
ASN A 467
 None
 0.96A 2zw9B-2d4eA:
3.1		 2zw9B-2d4eA:
22.07
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.
2d4e 5-CARBOXYMETHYL-2-HY
DROXYMUCONATE
SEMIALDEHYDE
DEHYDROGENASE

(Thermus
thermophilus) 		PF00171
(Aldedh) 		5 THR A 248
GLY A 477
GLY A 482
ASP A 483
ASN A 467
 None
 1.01A 2zw9B-2d4eA:
3.1		 2zw9B-2d4eA:
22.07
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.
2i6g PUTATIVE
METHYLTRANSFERASE

(Salmonella
enterica) 		PF03848
(TehB) 		5 GLY A  38
GLY A  40
ASP A  86
LEU A  87
ASN A  88
 None
 0.84A 2zw9B-2i6gA:
12.3		 2zw9B-2i6gA:
14.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2icy PROBABLE
UTP-GLUCOSE-1-PHOSPH
ATE
URIDYLYLTRANSFERASE
2

(Arabidopsis
thaliana) 		PF01704
(UDPGP) 		5 THR A  73
ASP A 229
LEU A  80
ASN A 154
TYR A 125
 None
 1.22A 2zw9B-2icyA:
2.6		 2zw9B-2icyA:
22.13
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.
2j04 YDR362CP

(Saccharomyces
cerevisiae) 		no annotation 5 GLY B 289
GLY B 664
ASP B 294
LEU B 665
ASP B 269
 None
 1.18A 2zw9B-2j04B:
6.0		 2zw9B-2j04B:
22.81
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.
2ls5 UNCHARACTERIZED
PROTEIN

(Bacteroides
thetaiotaomicron) 		PF08534
(Redoxin) 		5 GLY A  73
GLY A  97
ASP A  75
LEU A  20
LEU A  71
 None
 1.07A 2zw9B-2ls5A:
undetectable		 2zw9B-2ls5A:
11.94
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.
2ob1 LEUCINE CARBOXYL
METHYLTRANSFERASE 1

(Saccharomyces
cerevisiae) 		PF04072
(LCM) 		9 GLY A 105
GLY A 107
ASP A 109
ASP A 175
LEU A 176
ASN A 177
GLU A 201
TYR A 206
MET A 207
 None
None
PO4  A2001 (-3.1A)
None
None
None
None
None
None
 0.73A 2zw9B-2ob1A:
7.8		 2zw9B-2ob1A:
19.69
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.
2paa PHOSPHOGLYCERATE
KINASE, TESTIS
SPECIFIC

(Mus musculus) 		PF00162
(PGK) 		5 THR A 377
GLY A 395
GLY A 371
ASP A  23
ASN A  25
 None
 1.08A 2zw9B-2paaA:
2.9		 2zw9B-2paaA:
22.27
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.
2qtz METHIONINE SYNTHASE
REDUCTASE

(Homo sapiens) 		PF00175
(NAD_binding_1)
PF00667
(FAD_binding_1) 		5 GLY A 548
GLY A 651
ASP A 695
ASP A 586
LEU A 588
 None
None
FAD  A 700 ( 4.5A)
None
None
 1.17A 2zw9B-2qtzA:
4.2		 2zw9B-2qtzA:
22.87
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.
2rhq PHENYLALANYL-TRNA
SYNTHETASE BETA
CHAIN

(Staphylococcus
haemolyticus) 		PF01588
(tRNA_bind)
PF03147
(FDX-ACB)
PF03483
(B3_4)
PF03484
(B5) 		5 THR B 294
GLY B 327
ASP B 299
LEU B 321
ASN B 314
 None
 1.23A 2zw9B-2rhqB:
undetectable		 2zw9B-2rhqB:
22.39
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.
2uyo HYPOTHETICAL PROTEIN
ML2640

(Mycobacterium
leprae) 		PF04072
(LCM) 		6 THR A  17
GLY A 112
ASP A 114
LEU A 162
GLU A 186
TYR A 191
 None
 0.91A 2zw9B-2uyoA:
10.9		 2zw9B-2uyoA:
16.28
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.
2uyo HYPOTHETICAL PROTEIN
ML2640

(Mycobacterium
leprae) 		PF04072
(LCM) 		5 THR A  17
GLY A 112
ASP A 161
LEU A 162
TYR A 191
 None
 0.80A 2zw9B-2uyoA:
10.9		 2zw9B-2uyoA:
16.28
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.
2vod LUPUS LA PROTEIN

(Homo sapiens) 		PF00076
(RRM_1)
PF05383
(La) 		6 GLN A  39
GLY A  45
ASP A  33
LEU A  30
ASN A  29
GLU A  81
 None
None
U  C  -1 ( 2.8A)
None
U  C  -1 ( 4.1A)
None
 1.47A 2zw9B-2vodA:
undetectable		 2zw9B-2vodA:
13.53
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.
2wk2 CHITINASE A

(Serratia
marcescens) 		PF00704
(Glyco_hydro_18)
PF08329
(ChitinaseA_N) 		5 GLN A 532
GLY A 534
GLY A 435
LEU A 556
TYR A 527
 None
 1.16A 2zw9B-2wk2A:
undetectable		 2zw9B-2wk2A:
21.10
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.
2woc ADP-RIBOSYL-[DINITRO
GEN REDUCTASE]
GLYCOHYDROLASE

(Rhodospirillum
rubrum) 		PF03747
(ADP_ribosyl_GH) 		5 GLY A  16
GLY A  20
ASP A  21
LEU A 234
ASP A 263
 None
 1.04A 2zw9B-2wocA:
undetectable		 2zw9B-2wocA:
17.39
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.
2xva TELLURITE RESISTANCE
PROTEIN TEHB

(Escherichia
coli) 		PF03848
(TehB) 		5 GLY A  38
GLY A  40
ASP A  86
LEU A  87
ASN A  88
 SFG  A1198 (-4.3A)
SFG  A1198 (-3.2A)
SFG  A1198 (-3.9A)
SFG  A1198 (-3.8A)
SFG  A1198 (-4.0A)
 0.51A 2zw9B-2xvaA:
12.3		 2zw9B-2xvaA:
14.12
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.
2xyd ANGIOTENSIN-CONVERTI
NG ENZYME

(Homo sapiens) 		PF01401
(Peptidase_M2) 		5 GLN A 371
GLY A 547
ASP A 374
LEU A 375
TYR A 369
 None
 1.21A 2zw9B-2xydA:
undetectable		 2zw9B-2xydA:
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.
2z36 CYTOCHROME P450 TYPE
COMPACTIN
3'',4''-HYDROXYLASE

(Nonomuraea
recticatena) 		PF00067
(p450) 		5 THR A 249
GLY A 399
LEU A 256
LEU A 322
ASN A 325
 HEM  A 450 ( 3.7A)
None
None
None
None
 1.00A 2zw9B-2z36A:
undetectable		 2zw9B-2z36A:
20.78
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.
2zqq METHYLGLUTACONYL-COA
HYDRATASE

(Homo sapiens) 		PF00378
(ECH_1) 		5 GLY A 206
LEU A 182
ASP A 244
LEU A 243
GLU A 189
 None
 1.20A 2zw9B-2zqqA:
undetectable		 2zw9B-2zqqA:
18.03
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2zwa LEUCINE CARBOXYL
METHYLTRANSFERASE 2

(Saccharomyces
cerevisiae) 		PF04072
(LCM)
PF13418
(Kelch_4) 		12 GLN A  28
THR A  30
GLY A 115
GLY A 117
ASP A 119
LEU A 150
ASP A 196
LEU A 197
ASN A 198
GLU A 224
TYR A 229
MET A 230
 None
SAH  A 801 (-4.5A)
SAH  A 801 (-3.5A)
SAH  A 801 (-3.4A)
SAH  A 801 ( 4.3A)
SAH  A 801 (-4.6A)
SAH  A 801 (-4.1A)
SAH  A 801 (-3.7A)
SAH  A 801 (-3.9A)
SAH  A 801 (-3.0A)
None
SAH  A 801 ( 3.8A)
 0.31A 2zw9B-2zwaA:
56.8		 2zw9B-2zwaA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2zwa LEUCINE CARBOXYL
METHYLTRANSFERASE 2

(Saccharomyces
cerevisiae) 		PF04072
(LCM)
PF13418
(Kelch_4) 		6 GLY A 115
ASP A 119
LEU A 151
ASP A 196
LEU A 197
ASN A 198
 SAH  A 801 (-3.5A)
SAH  A 801 ( 4.3A)
None
SAH  A 801 (-4.1A)
SAH  A 801 (-3.7A)
SAH  A 801 (-3.9A)
 1.28A 2zw9B-2zwaA:
56.8		 2zw9B-2zwaA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2zwa LEUCINE CARBOXYL
METHYLTRANSFERASE 2

(Saccharomyces
cerevisiae) 		PF04072
(LCM)
PF13418
(Kelch_4) 		6 GLY A 115
GLY A 117
ASP A 119
LEU A 150
ASP A  24
GLU A 224
 SAH  A 801 (-3.5A)
SAH  A 801 (-3.4A)
SAH  A 801 ( 4.3A)
SAH  A 801 (-4.6A)
None
SAH  A 801 (-3.0A)
 1.37A 2zw9B-2zwaA:
56.8		 2zw9B-2zwaA:
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.
3aeh HEMOGLOBIN-BINDING
PROTEASE HBP
AUTOTRANSPORTER

(Escherichia
coli) 		PF03797
(Autotransporter) 		5 THR A1299
GLY A1107
GLY A1352
LEU A1109
GLU A1354
 None
 1.14A 2zw9B-3aehA:
undetectable		 2zw9B-3aehA:
18.73
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.
3ak5 HEMOGLOBIN-BINDING
PROTEASE HBP

(Escherichia
coli) 		PF02395
(Peptidase_S6) 		5 GLY A 398
GLY A 400
LEU A 162
LEU A 352
ASN A 353
 None
None
None
None
CA  A1200 ( 4.6A)
 1.14A 2zw9B-3ak5A:
undetectable		 2zw9B-3ak5A:
20.69
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.
3aup BASIC 7S GLOBULIN

(Glycine max) 		PF14541
(TAXi_C)
PF14543
(TAXi_N) 		5 GLY A 162
GLY A 160
ASP A  41
LEU A 168
LEU A 375
 None
 1.18A 2zw9B-3aupA:
undetectable		 2zw9B-3aupA:
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.
3ce6 ADENOSYLHOMOCYSTEINA
SE

(Mycobacterium
tuberculosis) 		PF00670
(AdoHcyase_NAD)
PF05221
(AdoHcyase) 		6 GLY A 268
GLY A 264
ASP A 263
LEU A 408
ASP A 388
ASN A 382
 None
 1.44A 2zw9B-3ce6A:
2.5		 2zw9B-3ce6A:
20.59
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.
3dgz THIOREDOXIN
REDUCTASE 2

(Mus musculus) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		5 THR A 335
GLY A  14
GLY A  18
LEU A  49
ASN A 107
 FAD  A 500 (-4.5A)
FAD  A 500 ( 4.7A)
None
None
None
 1.20A 2zw9B-3dgzA:
undetectable		 2zw9B-3dgzA:
20.99
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.
3dit PROTEIN MOTHERS
AGAINST DPP

(Drosophila
melanogaster) 		PF03166
(MH2) 		5 THR A 316
GLY A 323
GLY A 321
ASP A 340
MET A 404
 None
 1.23A 2zw9B-3ditA:
undetectable		 2zw9B-3ditA:
14.24
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.
3gmj PROTEIN MOTHERS
AGAINST DPP

(Drosophila
melanogaster) 		no annotation 5 THR D 316
GLY D 323
GLY D 321
ASP D 340
MET D 404
 None
 1.23A 2zw9B-3gmjD:
undetectable		 2zw9B-3gmjD:
15.89
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.
3iwj PUTATIVE
AMINOALDEHYDE
DEHYDROGENASE

(Pisum sativum) 		PF00171
(Aldedh) 		5 THR A 159
GLY A 222
LEU A 225
LEU A  10
GLU A 188
 None
NAD  A 504 (-3.8A)
None
None
NAD  A 504 (-3.1A)
 1.21A 2zw9B-3iwjA:
2.1		 2zw9B-3iwjA:
21.39
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.
3jys SUSD SUPERFAMILY
PROTEIN

(Bacteroides
vulgatus) 		PF07980
(SusD_RagB)
PF14322
(SusD-like_3) 		5 THR A 241
ASP A 171
LEU A 196
LEU A 204
ASN A 205
 None
 1.05A 2zw9B-3jysA:
undetectable		 2zw9B-3jysA:
20.89
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.
3kk7 PUTATIVE CELL
INVASION PROTEIN
WITH MAC/PERFORIN
DOMAIN

(Bacteroides
thetaiotaomicron) 		PF01823
(MACPF) 		5 GLY A 232
GLY A 358
ASP A 357
LEU A  73
TYR A  77
 None
 0.96A 2zw9B-3kk7A:
undetectable		 2zw9B-3kk7A:
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.
3n58 ADENOSYLHOMOCYSTEINA
SE

(Brucella
abortus) 		PF00670
(AdoHcyase_NAD)
PF05221
(AdoHcyase) 		6 GLY A 242
GLY A 238
ASP A 237
LEU A 379
ASP A 360
ASN A 354
 None
 1.43A 2zw9B-3n58A:
2.2		 2zw9B-3n58A:
21.25
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.
3n6z PUTATIVE
IMMUNOGLOBULIN A1
PROTEASE

(Bacteroides
ovatus) 		no annotation 5 GLY A 240
GLY A 203
LEU A 292
ASN A 291
TYR A 258
 None
 1.16A 2zw9B-3n6zA:
undetectable		 2zw9B-3n6zA:
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.
3o7w LEUCINE CARBOXYL
METHYLTRANSFERASE 1

(Homo sapiens) 		PF04072
(LCM) 		8 GLY A  98
GLY A 100
ASP A 102
ASP A 171
LEU A 172
GLU A 198
TYR A 203
MET A 204
 SAM  A 801 (-3.5A)
SAM  A 801 ( 3.7A)
None
SAM  A 801 (-3.8A)
SAM  A 801 (-3.7A)
SAM  A 801 (-3.1A)
SAM  A 801 (-4.6A)
None
 0.78A 2zw9B-3o7wA:
14.5		 2zw9B-3o7wA:
17.84
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.
3p3l CYTOCHROME P450

(Streptomyces
thioluteus) 		PF00067
(p450) 		5 GLN A 251
THR A 247
GLY A 395
LEU A 254
GLU A 390
 HEM  A 501 (-4.6A)
HEM  A 501 (-3.6A)
None
None
None
 1.23A 2zw9B-3p3lA:
undetectable		 2zw9B-3p3lA:
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.
3qfs NADPH--CYTOCHROME
P450 REDUCTASE

(Homo sapiens) 		PF00175
(NAD_binding_1)
PF00667
(FAD_binding_1) 		5 GLY A 539
GLY A 633
ASP A 677
ASP A 575
LEU A 577
 None
None
FAD  A 752 ( 4.9A)
None
None
 1.24A 2zw9B-3qfsA:
3.0		 2zw9B-3qfsA:
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.
3s47 MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN

(Clostridium
beijerinckii) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 THR A 400
ASP A 207
LEU A 212
LEU A 244
GLU A 259
 None
MG  A 402 (-3.0A)
None
None
MG  A 402 (-2.7A)
 1.20A 2zw9B-3s47A:
undetectable		 2zw9B-3s47A:
19.83
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.
3tji MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME,
N-TERMINAL DOMAIN
PROTEIN

(Enterobacter
sp. 638) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 THR A 398
ASP A 205
LEU A 210
LEU A 242
GLU A 257
 None
MG  A 601 (-2.7A)
None
None
MG  A 601 ( 2.4A)
 1.18A 2zw9B-3tjiA:
undetectable		 2zw9B-3tjiA:
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.
3tzw POLYKETIDE SYNTHASE
PKS13

(Mycobacterium
tuberculosis) 		PF00698
(Acyl_transf_1) 		6 GLN A 773
THR A 775
GLY A 720
GLY A 718
LEU A 802
TYR A 767
 SO4  A   6 ( 3.7A)
None
None
None
SO4  A   6 (-4.5A)
None
 1.01A 2zw9B-3tzwA:
undetectable		 2zw9B-3tzwA:
20.83
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.
3vd8 MALTOSE-BINDING
PERIPLASMIC PROTEIN,
INTERFERON-INDUCIBLE
PROTEIN AIM2

(Escherichia
coli;
Homo sapiens) 		PF02758
(PYRIN)
PF13416
(SBP_bac_8) 		5 GLY A1013
ASP A1015
LEU A1081
LEU A1072
ASN A1073
 None
 1.23A 2zw9B-3vd8A:
undetectable		 2zw9B-3vd8A:
20.64
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.
3vla EDGP

(Daucus carota) 		PF14541
(TAXi_C)
PF14543
(TAXi_N) 		5 GLY A 158
GLY A 156
ASP A  40
LEU A 164
LEU A 388
 None
 1.13A 2zw9B-3vlaA:
undetectable		 2zw9B-3vlaA:
21.22
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.
3wgc L-ALLO-THREONINE
ALDOLASE

(Aeromonas
jandaei) 		PF01212
(Beta_elim_lyase) 		5 GLY A  45
ASP A  47
LEU A 208
LEU A 172
ASN A 174
 None
 1.15A 2zw9B-3wgcA:
undetectable		 2zw9B-3wgcA:
17.29
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.
4av6 K(+)-STIMULATED
PYROPHOSPHATE-ENERGI
ZED SODIUM PUMP

(Thermotoga
maritima) 		PF03030
(H_PPase) 		5 GLY A 195
GLY A 239
ASP A 190
ASP A 692
GLU A  53
 None
None
None
MG  A1731 ( 2.4A)
None
 1.20A 2zw9B-4av6A:
undetectable		 2zw9B-4av6A:
22.56
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.
4emb 2,3-BISPHOSPHOGLYCER
ATE-DEPENDENT
PHOSPHOGLYCERATE
MUTASE

(Borreliella
burgdorferi) 		PF00300
(His_Phos_1) 		5 GLY A 179
ASP A 222
LEU A 221
ASN A 226
GLU A 175
 None
 1.09A 2zw9B-4embA:
undetectable		 2zw9B-4embA:
17.12
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.
4g2c DYP2

(Amycolatopsis
sp. ATCC 39116) 		no annotation 5 THR A 352
ASP A 373
ASP A 359
ASN A 361
GLU A 250
 None
 1.04A 2zw9B-4g2cA:
undetectable		 2zw9B-4g2cA:
19.97
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.
4hnl MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME

(Enterococcus
gallinarum) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 THR A 398
ASP A 205
LEU A 210
LEU A 242
GLU A 257
 None
MG  A 401 ( 2.6A)
None
None
MG  A 401 ( 2.4A)
 1.19A 2zw9B-4hnlA:
undetectable		 2zw9B-4hnlA:
18.83
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.
4kh3 ANTIGEN 43

(Escherichia
coli) 		PF16168
(AIDA) 		5 GLN A 225
GLY A 223
ASP A 222
ASN A 247
TYR A 207
 None
None
None
MLI  A 605 (-2.6A)
None
 1.18A 2zw9B-4kh3A:
undetectable		 2zw9B-4kh3A:
20.87
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.
4mhb PUTATIVE ALDO/KETO
REDUCTASE

(Yersinia pestis) 		PF00248
(Aldo_ket_red) 		5 GLN A 102
LEU A  89
LEU A 107
ASN A 108
GLU A 136
 None
 1.14A 2zw9B-4mhbA:
undetectable		 2zw9B-4mhbA:
18.79
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.
4mmo SSO-CP2
METALLO-CARBOXYPETID
ASE

(Sulfolobus
solfataricus) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		5 GLY A 101
ASP A 104
LEU A  12
LEU A  31
GLU A 138
 None
ZN  A 501 (-2.5A)
None
None
ZN  A 501 ( 4.5A)
 1.09A 2zw9B-4mmoA:
undetectable		 2zw9B-4mmoA:
21.83
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.
4n5i ESTERASE/LIPASE

(Lactobacillus
rhamnosus) 		PF07859
(Abhydrolase_3) 		5 THR X 143
GLY X  74
GLY X 148
LEU X  84
TYR X  88
 None
2HD  X 401 (-3.9A)
None
None
None
 1.10A 2zw9B-4n5iX:
3.0		 2zw9B-4n5iX:
17.60
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.
4o7q INTERFERON-INDUCIBLE
PROTEIN AIM2

(Homo sapiens) 		PF02758
(PYRIN) 		5 GLY A  13
ASP A  15
LEU A  81
LEU A  72
ASN A  73
 None
 1.12A 2zw9B-4o7qA:
undetectable		 2zw9B-4o7qA:
8.63
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.
4oby ARGININE--TRNA
LIGASE

(Escherichia
coli) 		PF00750
(tRNA-synt_1d)
PF03485
(Arg_tRNA_synt_N)
PF05746
(DALR_1) 		5 GLY A 427
GLY A 425
LEU A 450
ASN A 455
GLU A 572
 None
 1.18A 2zw9B-4obyA:
undetectable		 2zw9B-4obyA:
21.61
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.
4ph9 PROSTAGLANDIN G/H
SYNTHASE 2

(Mus musculus) 		PF00008
(EGF)
PF03098
(An_peroxidase) 		5 GLN A 331
THR A 332
GLY A 325
GLY A 251
ASP A 250
 None
 1.24A 2zw9B-4ph9A:
undetectable		 2zw9B-4ph9A:
21.22
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.
4qi6 CELLOBIOSE
DEHYDROGENASE

(Crassicarpon
hotsonii) 		PF00732
(GMC_oxred_N)
PF00734
(CBM_1)
PF05199
(GMC_oxred_C)
PF16010
(CDH-cyt) 		5 THR A 750
GLY A 238
GLY A 240
ASP A 737
LEU A 314
 FAD  A 902 (-3.7A)
FAD  A 902 (-3.1A)
FAD  A 902 (-4.2A)
FAD  A 902 (-4.8A)
None
 0.98A 2zw9B-4qi6A:
undetectable		 2zw9B-4qi6A:
20.60
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.
4ruw ENDONUCLEASE/EXONUCL
EASE/PHOSPHATASE

(Beutenbergia
cavernae) 		PF03372
(Exo_endo_phos) 		5 GLY A 273
GLY A 271
ASP A 269
LEU A 319
TYR A 294
 None
None
GOL  A 503 (-3.0A)
None
None
 1.17A 2zw9B-4ruwA:
undetectable		 2zw9B-4ruwA:
19.54
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.
4yhb IRON-CHELATOR
UTILIZATION PROTEIN

(Thermobifida
fusca) 		PF04954
(SIP)
PF08021
(FAD_binding_9) 		5 GLY A 254
GLY A 226
LEU A 263
ASN A 262
GLU A 251
 None
 1.12A 2zw9B-4yhbA:
3.3		 2zw9B-4yhbA:
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.
5awf FES CLUSTER ASSEMBLY
PROTEIN SUFB

(Escherichia
coli) 		PF01458
(UPF0051) 		5 THR A 357
GLY A 376
ASP A 406
LEU A 486
ASN A 286
 None
 1.24A 2zw9B-5awfA:
undetectable		 2zw9B-5awfA:
22.19
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.
5csc CITRATE SYNTHASE

(Gallus gallus) 		PF00285
(Citrate_synt) 		5 THR B  55
GLY B  99
LEU B  95
LEU B   6
GLU B  17
 None
 1.18A 2zw9B-5cscB:
undetectable		 2zw9B-5cscB:
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.
5cxw PENICILLIN-BINDING
PROTEIN 1A

(Mycobacterium
tuberculosis) 		PF00905
(Transpeptidase) 		5 THR A 580
GLY A 570
ASP A 307
LEU A 301
GLU A 576
 None
 1.18A 2zw9B-5cxwA:
undetectable		 2zw9B-5cxwA:
19.29
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.
5cyw INTERFERON
ANTAGONIST C7

(Vaccinia virus) 		PF03287
(Pox_C7_F8A) 		5 GLY B  29
ASP B 103
LEU B  61
ASP B   8
LEU B  20
 None
 1.24A 2zw9B-5cywB:
undetectable		 2zw9B-5cywB:
13.64
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.
5dan 2,5-DIKETO-D-GLUCONI
C ACID REDUCTASE

(Thermotoga
maritima) 		PF00248
(Aldo_ket_red) 		5 GLY A  22
GLY A  24
ASP A  30
ASP A  53
TYR A  57
 None
None
None
NAP  A 301 (-3.8A)
None
 1.19A 2zw9B-5danA:
undetectable		 2zw9B-5danA:
16.59
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.
5dzt CYLM

(Enterococcus
faecalis) 		PF05147
(LANC_like)
PF13575
(DUF4135) 		5 GLY A 965
GLY A 972
LEU A 690
ASN A 691
TYR A 695
 None
 1.00A 2zw9B-5dztA:
undetectable		 2zw9B-5dztA:
22.91
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.
5f5n MONOOXYGENASE

(Micromonospora
sp. TP-A0468) 		PF05368
(NmrA) 		5 GLY A  12
GLY A  15
ASP A  58
LEU A  59
ASN A  60
 NAD  A 301 (-3.4A)
NAD  A 301 (-3.3A)
NAD  A 301 (-3.2A)
NAD  A 301 (-3.7A)
NAD  A 301 ( 4.1A)
 1.23A 2zw9B-5f5nA:
3.1		 2zw9B-5f5nA:
16.45
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.
5gmx CARBOXYLESTERASE

(uncultured
bacterium) 		PF00144
(Beta-lactamase) 		5 GLY A 372
GLY A 346
ASP A 367
LEU A 331
ASN A 327
 None
 1.20A 2zw9B-5gmxA:
undetectable		 2zw9B-5gmxA:
19.74
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.
5ihv BETA-LACTAMASE

(Burkholderia
ambifaria) 		PF13354
(Beta-lactamase2) 		5 THR A 221
GLY A 216
GLY A 218
ASP A 153
LEU A 148
 None
 1.21A 2zw9B-5ihvA:
undetectable		 2zw9B-5ihvA:
17.58
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.
5iig VACUOLAR TRANSPORTER
CHAPERONE 4

(Saccharomyces
cerevisiae) 		PF03105
(SPX)
PF09359
(VTC) 		5 GLY A 390
ASP A 392
ASP A 469
LEU A 467
ASN A 468
 None
 1.17A 2zw9B-5iigA:
undetectable		 2zw9B-5iigA:
22.98
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.
5ikr PROSTAGLANDIN G/H
SYNTHASE 2

(Homo sapiens) 		PF00008
(EGF)
PF03098
(An_peroxidase) 		5 GLN A 330
THR A 331
GLY A 324
GLY A 250
ASP A 249
 None
 1.23A 2zw9B-5ikrA:
undetectable		 2zw9B-5ikrA:
20.89
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.
5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER

(Shigella
flexneri) 		PF02395
(Peptidase_S6) 		5 GLY A 346
GLY A 348
LEU A 115
LEU A 300
ASN A 301
 None
 1.20A 2zw9B-5j44A:
undetectable		 2zw9B-5j44A:
20.56
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.
5j7z PUTATIVE SECRETED
ENDOGLYCOSYLCERAMIDA
SE

(Rhodococcus
hoagii) 		PF00150
(Cellulase) 		5 GLY A 134
ASP A 133
LEU A 171
ASP A 176
GLU A 214
 None
BGC  A 604 (-2.6A)
None
None
18C  A 607 (-3.0A)
 1.05A 2zw9B-5j7zA:
undetectable		 2zw9B-5j7zA:
20.48
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.
5k9z PUTATIVE SHORT-CHAIN
DEHYDROGENASE/REDUCT
ASE

(Paraburkholderia
xenovorans) 		PF13561
(adh_short_C2) 		5 GLN A 226
GLY A  28
GLY A  26
LEU A 232
MET A  35
 None
 1.23A 2zw9B-5k9zA:
5.3		 2zw9B-5k9zA:
15.74
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.
5kf7 BIFUNCTIONAL PROTEIN
PUTA

(Sinorhizobium
meliloti) 		PF00171
(Aldedh)
PF01619
(Pro_dh)
PF14850
(Pro_dh-DNA_bdg) 		5 GLY A 992
GLY A1012
LEU A 970
LEU A 994
GLU A1213
 None
None
NAD  A2002 ( 4.8A)
None
None
 1.18A 2zw9B-5kf7A:
undetectable		 2zw9B-5kf7A:
19.13
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.
5obt VACUOLAR-PROCESSING
ENZYME GAMMA-ISOZYME
VACUOLAR-PROCESSING
ENZYME GAMMA-ISOZYME

(Arabidopsis
thaliana;
Arabidopsis
thaliana) 		no annotation
no annotation 		5 GLN A  55
GLY E 329
LEU E 326
LEU A  91
ASN A  95
 None
 1.17A 2zw9B-5obtA:
2.5		 2zw9B-5obtA:
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.
5v36 GLUTATHIONE
REDUCTASE

(Streptococcus
mutans) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		5 THR A  41
GLY A  15
GLY A  12
LEU A 301
ASN A 305
 FAD  A 501 (-3.5A)
FAD  A 501 (-3.5A)
FAD  A 501 ( 4.9A)
None
None
 1.08A 2zw9B-5v36A:
undetectable		 2zw9B-5v36A:
20.22
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.
5v36 GLUTATHIONE
REDUCTASE

(Streptococcus
mutans) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		5 THR A  41
GLY A  16
GLY A  12
LEU A 301
ASN A 305
 FAD  A 501 (-3.5A)
None
FAD  A 501 ( 4.9A)
None
None
 1.11A 2zw9B-5v36A:
undetectable		 2zw9B-5v36A:
20.22
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.
5x2o TASTE RECEPTOR, TYPE
1, MEMBER 3

(Oryzias latipes) 		PF01094
(ANF_receptor) 		5 GLN B 380
THR B 382
GLY B  74
LEU B 333
LEU B 373
 None
 1.22A 2zw9B-5x2oB:
2.4		 2zw9B-5x2oB:
21.10
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.
5xoy [LYSW]-LYSINE
HYDROLASE

(Thermus
thermophilus) 		PF01546
(Peptidase_M20) 		5 GLY A  88
ASP A  91
LEU A  16
LEU A  32
GLU A 125
 None
None
None
None
LYS  A 401 (-3.7A)
 1.15A 2zw9B-5xoyA:
undetectable		 2zw9B-5xoyA:
19.42
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.
5xoy [LYSW]-LYSINE
HYDROLASE

(Thermus
thermophilus) 		PF01546
(Peptidase_M20) 		5 GLY A  94
GLY A  88
ASP A  91
LEU A  16
GLU A 148
 None
 1.12A 2zw9B-5xoyA:
undetectable		 2zw9B-5xoyA:
19.42
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.
5xyi 40S RIBOSOMAL
PROTEIN S17-B,
PUTATIVE
GUANINE
NUCLEOTIDE-BINDING
PROTEIN BETA
SUBUNIT, PUTATIVE

(Trichomonas
vaginalis;
Trichomonas
vaginalis) 		PF00833
(Ribosomal_S17e)
no annotation 		5 GLN R  23
GLY g 189
GLY g 211
ASP g 210
ASN g 144
 None
 1.08A 2zw9B-5xyiR:
undetectable		 2zw9B-5xyiR:
11.46
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.
5zic -

(-) 		no annotation 5 THR A 548
GLY A 516
ASP A 580
LEU A 581
ASN A 582
 None
 0.85A 2zw9B-5zicA:
undetectable		 2zw9B-5zicA:
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.
5zl9 CHITINASE AB

(Serratia
marcescens) 		no annotation 5 GLN A 534
GLY A 536
GLY A 437
LEU A 558
TYR A 529
 None
 1.10A 2zw9B-5zl9A:
undetectable		 2zw9B-5zl9A:
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.
6c6l V-TYPE PROTON ATPASE
SUBUNIT C'

(Saccharomyces
cerevisiae) 		no annotation 5 GLY D 123
GLY D 120
ASP D 121
LEU D 141
LEU D 133
 None
 0.94A 2zw9B-6c6lD:
undetectable		 2zw9B-6c6lD:
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.
6es9 ACYL-COA
DEHYDROGENASE

(Paracoccus
denitrificans) 		no annotation 5 THR A 334
GLY A 403
LEU A 331
LEU A 348
GLU A 399
 None
 0.95A 2zw9B-6es9A:
undetectable		 2zw9B-6es9A:
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.
6esl BACTERIAL LEUCYL
AMINOPEPTIDASE

(Legionella
pneumophila) 		no annotation 5 GLY A 209
GLY A 206
ASP A 207
LEU A 356
GLU A 242
 None
None
ZN  A 402 ( 2.2A)
None
ZN  A 401 (-2.3A)
 1.23A 2zw9B-6eslA:
undetectable		 2zw9B-6eslA:
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.
1cnv CONCANAVALIN B

(Canavalia
ensiformis) 		PF00704
(Glyco_hydro_18) 		4 ILE A 279
ASN A  27
ASP A 270
TYR A 275
 None
 1.12A 2zw9B-1cnvA:
undetectable		 2zw9B-1cnvA:
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.
1exf EXFOLIATVE TOXIN A

(Staphylococcus
aureus) 		PF13365
(Trypsin_2) 		4 ASN A 194
SER A 197
ASP A 144
SER A  41
 None
 1.03A 2zw9B-1exfA:
undetectable		 2zw9B-1exfA:
17.02
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.
1hzo BETA-LACTAMASE

(Proteus
vulgaris) 		PF13354
(Beta-lactamase2) 		4 ILE A 247
SER A 130
TYR A 264
SER A  72
 None
MES  A1000 (-2.7A)
None
None
 1.00A 2zw9B-1hzoA:
undetectable		 2zw9B-1hzoA:
17.99
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.
1r5m SIR4-INTERACTING
PROTEIN SIF2

(Saccharomyces
cerevisiae) 		PF00400
(WD40)
PF12894
(ANAPC4_WD40) 		4 ILE A 445
SER A 363
ASP A 421
SER A 417
 None
 1.16A 2zw9B-1r5mA:
6.5		 2zw9B-1r5mA:
21.19
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.
1ua7 ALPHA-AMYLASE

(Bacillus
subtilis) 		PF00128
(Alpha-amylase) 		4 ILE A 235
SER A 278
ARG A 306
TYR A 231
 None
 1.15A 2zw9B-1ua7A:
undetectable		 2zw9B-1ua7A:
21.44
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.
1uls PUTATIVE
3-OXOACYL-ACYL
CARRIER PROTEIN
REDUCTASE

(Thermus
thermophilus) 		PF13561
(adh_short_C2) 		4 ASN A 108
SER A 151
TYR A  84
SER A 136
 None
 1.09A 2zw9B-1ulsA:
5.4		 2zw9B-1ulsA:
16.57
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.
1uzn 3-OXOACYL-[ACYL-CARR
IER PROTEIN]
REDUCTASE

(Mycobacterium
tuberculosis) 		PF13561
(adh_short_C2) 		4 ILE A 138
ASN A 112
SER A 156
SER A 140
 None
 1.14A 2zw9B-1uznA:
5.3		 2zw9B-1uznA:
16.74
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.
1ytm PHOSPHOENOLPYRUVATE
CARBOXYKINASE [ATP]

(Anaerobiospirillum
succiniciproducens) 		PF01293
(PEPCK_ATP) 		4 ILE A 452
ASN A 434
SER A 355
SER A 366
 None
 1.04A 2zw9B-1ytmA:
undetectable		 2zw9B-1ytmA:
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.
1z3v CELLULASE

(Phanerochaete
chrysosporium) 		PF00840
(Glyco_hydro_7) 		4 ILE A 363
ASN A 214
LYS A 265
SER A 411
 None
 0.89A 2zw9B-1z3vA:
undetectable		 2zw9B-1z3vA:
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.
1zbh 3'-5' EXONUCLEASE
ERI1

(Homo sapiens) 		PF00929
(RNase_T)
PF02037
(SAP) 		4 ILE A 318
ASN A 259
SER A 232
SER A 329
 None
None
None
C  F  20 ( 3.3A)
 1.09A 2zw9B-1zbhA:
undetectable		 2zw9B-1zbhA:
17.86
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.
2bi7 UDP-GALACTOPYRANOSE
MUTASE

(Klebsiella
pneumoniae) 		PF03275
(GLF)
PF13450
(NAD_binding_8) 		4 ILE A 205
SER A  42
TYR A  72
SER A  14
 None
FAD  A1385 ( 3.8A)
None
FAD  A1385 (-2.6A)
 0.97A 2zw9B-2bi7A:
undetectable		 2zw9B-2bi7A:
19.88
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.
2bpa PROTEIN (SUBUNIT OF
BACTERIOPHAGE
PHIX174)

(Escherichia
virus phiX174) 		PF02305
(Phage_F) 		4 ILE 1 219
ASP 1 231
TYR 1 215
SER 1 227
 None
 1.09A 2zw9B-2bpa1:
undetectable		 2zw9B-2bpa1:
20.17
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.
2c07 3-OXOACYL-(ACYL-CARR
IER PROTEIN)
REDUCTASE

(Plasmodium
falciparum) 		PF13561
(adh_short_C2) 		4 ILE A 197
ASN A 171
SER A 215
SER A 199
 None
 1.09A 2zw9B-2c07A:
5.8		 2zw9B-2c07A:
18.33
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.
2hrb CARBONYL REDUCTASE
[NADPH] 3

(Homo sapiens) 		PF00106
(adh_short) 		4 ILE A 138
ASN A 114
SER A 197
SER A 140
 NAP  A1001 (-4.2A)
None
None
NAP  A1001 ( 4.0A)
 1.14A 2zw9B-2hrbA:
5.8		 2zw9B-2hrbA:
16.91
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.
2hsd 3-ALPHA, 20
BETA-HYDROXYSTEROID
DEHYDROGENASE

(Streptomyces
exfoliatus) 		PF13561
(adh_short_C2) 		4 ILE A 137
ASN A 111
SER A 155
SER A 139
 NAD  A 256 (-4.6A)
None
None
NAD  A 256 (-3.4A)
 1.11A 2zw9B-2hsdA:
5.8		 2zw9B-2hsdA:
15.56
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.
2i71 HYPOTHETICAL PROTEIN

(Sulfolobus
solfataricus) 		PF09455
(Cas_DxTHG) 		4 ILE A  22
SER A  29
ASP A 125
TYR A 161
 None
 1.13A 2zw9B-2i71A:
1.8		 2zw9B-2i71A:
20.03
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.
2k75 UNCHARACTERIZED
PROTEIN TA0387

(Thermoplasma
acidophilum) 		no annotation 4 ILE A  68
ASN A  70
SER A  87
SER A  83
 None
 0.87A 2zw9B-2k75A:
undetectable		 2zw9B-2k75A:
9.35
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.
2okx RHAMNOSIDASE B

(Bacillus sp.
GL1) 		PF05592
(Bac_rhamnosid)
PF08531
(Bac_rhamnosid_N)
PF17389
(Bac_rhamnosid6H)
PF17390
(Bac_rhamnosid_C) 		4 ILE A 195
SER A 529
ARG A 502
ASP A  74
 None
 1.10A 2zw9B-2okxA:
undetectable		 2zw9B-2okxA:
21.41
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.
2ph3 3-OXOACYL-[ACYL
CARRIER PROTEIN]
REDUCTASE

(Thermus
thermophilus) 		PF13561
(adh_short_C2) 		4 ILE A 137
ASN A 111
SER A 155
SER A 139
 None
 1.06A 2zw9B-2ph3A:
5.1		 2zw9B-2ph3A:
16.45
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.
2vsa MOSQUITOCIDAL TOXIN

(Lysinibacillus
sphaericus) 		PF05588
(Botulinum_HA-17)
PF14200
(RicinB_lectin_2) 		4 ILE A  64
ASN A 860
SER A 735
SER A  66
 None
 1.08A 2zw9B-2vsaA:
undetectable		 2zw9B-2vsaA:
21.50
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.
2wyx BETA-LACTAMSE TOHO-1

(Escherichia
coli) 		PF13354
(Beta-lactamase2) 		4 ILE A 247
SER A 130
TYR A 264
SER A  72
 None
 0.96A 2zw9B-2wyxA:
undetectable		 2zw9B-2wyxA:
15.98
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.
2wzf GLUCOSYLTRANSFERASE

(Legionella
pneumophila) 		PF16849
(Glyco_transf_88) 		4 ILE A 297
ASN A 293
ARG A 502
ASP A 246
 None
BGC  A1526 (-3.0A)
None
BGC  A1526 (-2.7A)
 1.08A 2zw9B-2wzfA:
undetectable		 2zw9B-2wzfA:
19.75
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.
2ya1 PUTATIVE ALKALINE
AMYLOPULLULANASE

(Streptococcus
pneumoniae) 		PF00128
(Alpha-amylase)
PF02922
(CBM_48)
PF03714
(PUD) 		4 ILE A 335
ASN A 347
SER A 237
ASP A 353
 None
None
None
NA  A2157 (-3.9A)
 1.12A 2zw9B-2ya1A:
undetectable		 2zw9B-2ya1A:
22.35
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.
2zoa PHOSPHOHYDROLASE

(Klebsiella
aerogenes) 		PF00149
(Metallophos) 		4 ILE A  51
SER A 121
ASP A   8
SER A  48
 None
None
FE2  A 275 ( 3.1A)
None
 1.01A 2zw9B-2zoaA:
2.1		 2zw9B-2zoaA:
16.14
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2zwa LEUCINE CARBOXYL
METHYLTRANSFERASE 2

(Saccharomyces
cerevisiae) 		PF04072
(LCM)
PF13418
(Kelch_4) 		8 ILE A  27
ASN A  31
SER A  34
LYS A  38
ARG A  88
ASP A 146
TYR A 147
SER A 226
 SAH  A 801 (-4.4A)
SAH  A 801 (-4.6A)
SAH  A 801 (-3.6A)
SAH  A 801 (-2.8A)
SAH  A 801 (-3.9A)
SAH  A 801 (-2.9A)
SAH  A 801 (-3.8A)
SAH  A 801 (-4.6A)
 0.31A 2zw9B-2zwaA:
56.8		 2zw9B-2zwaA:
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.
3a9g PUTATIVE
UNCHARACTERIZED
PROTEIN

(Pyrobaculum
aerophilum) 		PF07995
(GSDH) 		4 ILE A 342
SER A  39
ASP A 339
SER A 367
 None
 1.05A 2zw9B-3a9gA:
1.7		 2zw9B-3a9gA:
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.
3bfg CLASS A
BETA-LACTAMASE SED1

(Citrobacter
sedlakii) 		PF13354
(Beta-lactamase2) 		4 ILE A 247
SER A 130
TYR A 264
SER A  72
 None
MER  A 301 (-2.6A)
None
None
 0.95A 2zw9B-3bfgA:
undetectable		 2zw9B-3bfgA:
18.08
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.
3bsf AT4G34840

(Arabidopsis
thaliana) 		PF01048
(PNP_UDP_1) 		4 ILE A  93
ASN A  60
SER A  14
ARG A  11
 None
 1.16A 2zw9B-3bsfA:
undetectable		 2zw9B-3bsfA:
17.46
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.
3eeg 2-ISOPROPYLMALATE
SYNTHASE

(Cytophaga
hutchinsonii) 		PF00682
(HMGL-like) 		4 ILE A  83
SER A  57
LYS A  28
SER A  50
 None
 1.05A 2zw9B-3eegA:
undetectable		 2zw9B-3eegA:
18.63
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.
3emk GLUCOSE/RIBITOL
DEHYDROGENASE

(Brucella
melitensis) 		PF13561
(adh_short_C2) 		4 ILE A 137
ASN A 111
SER A 155
SER A 139
 None
 1.06A 2zw9B-3emkA:
5.7		 2zw9B-3emkA:
14.76
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.
3fed GLUTAMATE
CARBOXYPEPTIDASE III

(Homo sapiens) 		PF02225
(PA)
PF04253
(TFR_dimer)
PF04389
(Peptidase_M28) 		4 ILE A 440
SER A 436
ARG A 663
SER A 522
 None
 1.09A 2zw9B-3fedA:
undetectable		 2zw9B-3fedA:
21.71
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.
3fzy RTX TOXIN RTXA

(Vibrio cholerae) 		PF11713
(Peptidase_C80) 		4 ILE A3584
LYS A3511
ARG A3457
SER A3632
 UNX  A 327 (-4.3A)
CL  A   1 ( 4.2A)
IHP  A8000 ( 4.0A)
None
 1.05A 2zw9B-3fzyA:
undetectable		 2zw9B-3fzyA:
15.14
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.
3gcd RTX TOXIN RTXA

(Vibrio cholerae) 		PF11713
(Peptidase_C80) 		4 ILE A 156
LYS A  83
ARG A  29
SER A 204
 None
None
IHP  A 214 (-4.0A)
None
 0.99A 2zw9B-3gcdA:
undetectable		 2zw9B-3gcdA:
13.93
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.
3h09 IMMUNOGLOBULIN A1
PROTEASE

(Haemophilus
influenzae) 		PF02395
(Peptidase_S6)
PF03212
(Pertactin) 		4 ILE A  86
SER A 137
TYR A 239
SER A 102
 None
 1.03A 2zw9B-3h09A:
undetectable		 2zw9B-3h09A:
20.42
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.
3h4r EXODEOXYRIBONUCLEASE
8

(Escherichia
coli) 		PF12684
(DUF3799) 		4 ILE A 614
ASN A 835
TYR A 629
SER A 617
 None
 1.10A 2zw9B-3h4rA:
undetectable		 2zw9B-3h4rA:
16.52
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.
3hzs MONOFUNCTIONAL
GLYCOSYLTRANSFERASE

(Staphylococcus
aureus) 		PF00912
(Transgly) 		4 ILE A  97
SER A 221
ARG A 241
TYR A 254
 None
 1.05A 2zw9B-3hzsA:
undetectable		 2zw9B-3hzsA:
15.62
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.
3igo CALMODULIN-DOMAIN
PROTEIN KINASE 1

(Cryptosporidium
parvum) 		PF00069
(Pkinase)
PF13499
(EF-hand_7) 		4 ILE A 456
ASP A 131
TYR A 452
SER A 374
 None
 1.01A 2zw9B-3igoA:
undetectable		 2zw9B-3igoA:
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.
3iuu PUTATIVE
METALLOPEPTIDASE

(Chelativorans
sp. BNC1) 		PF07171
(MlrC_C)
PF07364
(DUF1485) 		4 ILE A 154
ASP A 226
TYR A 248
SER A 156
 None
 1.15A 2zw9B-3iuuA:
undetectable		 2zw9B-3iuuA:
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.
3jr3 NAD-DEPENDENT
DEACETYLASE

(Thermotoga
maritima) 		PF02146
(SIR2) 		4 ILE A  50
ASN A  46
SER A  44
SER A  55
 None
 1.09A 2zw9B-3jr3A:
2.4		 2zw9B-3jr3A:
18.30
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.
3khd PYRUVATE KINASE

(Plasmodium
falciparum) 		PF00224
(PK)
PF02887
(PK_C) 		4 ILE A 396
ASN A 312
TYR A 438
SER A 391
 None
 1.10A 2zw9B-3khdA:
undetectable		 2zw9B-3khdA:
22.50
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.
3lhl PUTATIVE AGMATINASE

(Clostridioides
difficile) 		PF00491
(Arginase) 		4 ILE A  97
ASN A  22
TYR A  18
SER A 101
 None
 1.06A 2zw9B-3lhlA:
3.4		 2zw9B-3lhlA:
18.34
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.
3lq0 PROASTACIN

(Astacus astacus) 		PF01400
(Astacin) 		4 ILE A   4
LYS A 179
TYR A  13
SER A 153
 None
 1.10A 2zw9B-3lq0A:
undetectable		 2zw9B-3lq0A:
16.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3m0e TRANSCRIPTIONAL
REGULATOR (NTRC
FAMILY)

(Aquifex
aeolicus) 		PF00158
(Sigma54_activat) 		4 ILE A 165
ASN A 280
SER A 169
ARG A 357
 None
ATP  A 400 (-4.2A)
ATP  A 400 (-2.6A)
ATP  A 400 (-3.3A)
 1.02A 2zw9B-3m0eA:
2.5		 2zw9B-3m0eA:
17.55
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.
3n2e SHIKIMATE KINASE

(Helicobacter
pylori) 		PF01202
(SKI) 		4 ILE A  82
SER A  12
ASP A  33
SER A  77
 None
 0.99A 2zw9B-3n2eA:
undetectable		 2zw9B-3n2eA:
11.91
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.
3ne8 N-ACETYLMURAMOYL-L-A
LANINE AMIDASE

(Bartonella
henselae) 		PF01520
(Amidase_3) 		4 ASN A 329
SER A 332
LYS A 336
TYR A 401
 GOL  A 413 ( 4.0A)
None
None
GOL  A 413 ( 4.9A)
 1.02A 2zw9B-3ne8A:
undetectable		 2zw9B-3ne8A:
15.57
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.
3oja ANOPHELES
PLASMODIUM-RESPONSIV
E LEUCINE-RICH
REPEAT PROTEIN 1

(Anopheles
gambiae) 		PF13855
(LRR_8) 		4 ASN B 391
ARG B 621
ASP B 387
SER B 413
 None
 1.11A 2zw9B-3ojaB:
undetectable		 2zw9B-3ojaB:
20.97
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.
3p4g ANTIFREEZE PROTEIN

(Marinomonas
primoryensis) 		no annotation 4 ILE A 164
ASN A 129
SER A 131
SER A 169
 None
MG  A 325 ( 4.8A)
None
None
 1.11A 2zw9B-3p4gA:
undetectable		 2zw9B-3p4gA:
19.15
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.
3q4d MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME
FAMILY
POSSIBLE
CHLOROMUCONATE
CYCLOISOMERASE

(Cytophaga
hutchinsonii) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		4 ILE A  98
ASN A 103
SER A  85
SER A  96
 None
 1.11A 2zw9B-3q4dA:
undetectable		 2zw9B-3q4dA:
21.23
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.
3qjg EPIDERMIN
BIOSYNTHESIS PROTEIN
EPID

(Staphylococcus
aureus) 		PF02441
(Flavoprotein) 		4 ILE A 112
ASN A 115
SER A  12
SER A  84
 None
FMN  A 501 (-4.2A)
FMN  A 501 (-2.6A)
None
 0.94A 2zw9B-3qjgA:
2.9		 2zw9B-3qjgA:
13.13
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.
3qm2 PHOSPHOSERINE
AMINOTRANSFERASE

(Salmonella
enterica) 		PF00266
(Aminotran_5) 		4 ILE A 159
ASN A 151
SER A 177
LYS A 198
 None
 1.09A 2zw9B-3qm2A:
undetectable		 2zw9B-3qm2A:
20.57
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.
3qp6 CVIR TRANSCRIPTIONAL
REGULATOR

(Chromobacterium
violaceum) 		PF00196
(GerE)
PF03472
(Autoind_bind) 		4 ILE A  69
ASN A  67
ARG A  10
SER A 152
 None
 1.04A 2zw9B-3qp6A:
undetectable		 2zw9B-3qp6A:
18.05
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.
3sju KETO REDUCTASE

(Streptomyces
griseoruber) 		PF00106
(adh_short) 		4 ILE A 140
ASN A 112
SER A 158
SER A 142
 NDP  A 301 (-4.3A)
None
None
NDP  A 301 (-3.7A)
 1.09A 2zw9B-3sjuA:
undetectable		 2zw9B-3sjuA:
17.65
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.
3thz DNA MISMATCH REPAIR
PROTEIN MSH2

(Homo sapiens) 		PF00488
(MutS_V)
PF01624
(MutS_I)
PF05188
(MutS_II)
PF05190
(MutS_IV)
PF05192
(MutS_III) 		4 SER A 284
ARG A 171
TYR A 121
SER A 129
 None
 1.10A 2zw9B-3thzA:
undetectable		 2zw9B-3thzA:
22.73
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.
3tsc PUTATIVE
OXIDOREDUCTASE

(Mycobacterium
avium) 		PF13561
(adh_short_C2) 		4 ILE A 155
ASN A 128
SER A 173
SER A 157
 NAD  A 274 (-4.6A)
None
None
NAD  A 274 (-3.6A)
 1.06A 2zw9B-3tscA:
2.5		 2zw9B-3tscA:
17.47
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.
3uf0 SHORT-CHAIN
DEHYDROGENASE/REDUCT
ASE SDR

(Beutenbergia
cavernae) 		PF13561
(adh_short_C2) 		4 ILE A 141
ASN A 115
SER A 159
SER A 143
 NAP  A 274 (-4.3A)
None
None
NAP  A 274 (-3.5A)
 1.15A 2zw9B-3uf0A:
5.4		 2zw9B-3uf0A:
15.09
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.
3wqo UNCHARACTERIZED
PROTEIN MJ1311

(Methanocaldococcus
jannaschii) 		PF01261
(AP_endonuc_2) 		4 ILE A 148
ASN A 186
SER A 184
TYR A 152
 None
 1.03A 2zw9B-3wqoA:
undetectable		 2zw9B-3wqoA:
18.82
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.
3wxb UNCHARACTERIZED
PROTEIN

(Gallus gallus) 		PF00106
(adh_short) 		4 ILE A 157
ASN A 120
SER A 181
SER A 159
 NDP  A 300 (-4.4A)
None
None
EDO  A 301 ( 2.5A)
 1.14A 2zw9B-3wxbA:
6.5		 2zw9B-3wxbA:
17.05
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.
3zny CTX-M-12A ENZYME

(Klebsiella
pneumoniae) 		PF13354
(Beta-lactamase2) 		4 ILE A 247
SER A 130
TYR A 264
SER A  72
 None
 0.92A 2zw9B-3znyA:
undetectable		 2zw9B-3znyA:
17.93
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.
4b97 CELLULOSE BINDING
DOMAIN-CONTAINING
PROTEIN

(Ruminiclostridium
thermocellum) 		PF00942
(CBM_3) 		4 ILE A  47
ASN A 117
ASP A 121
TYR A  45
 None
None
CA  A1152 (-2.9A)
None
 0.97A 2zw9B-4b97A:
undetectable		 2zw9B-4b97A:
11.53
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.
4cql ESTRADIOL
17-BETA-DEHYDROGENAS
E 8

(Homo sapiens) 		PF13561
(adh_short_C2) 		4 ILE A 154
ASN A 127
SER A 172
SER A 156
 NAD  A 301 (-4.6A)
None
None
NAD  A 301 (-3.1A)
 1.00A 2zw9B-4cqlA:
5.4		 2zw9B-4cqlA:
17.00
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.
4cyv HEMAGGLUTININ

(Influenza A
virus) 		PF00509
(Hemagglutinin) 		4 ILE B 152
ASN B 154
TYR B 157
SER B 147
 None
NAG  B 211 (-1.9A)
None
None
 1.11A 2zw9B-4cyvB:
undetectable		 2zw9B-4cyvB:
13.21
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.
4fda 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
REDUCTASE

(Saccharomyces
cerevisiae) 		PF00106
(adh_short) 		4 ILE A 181
ASN A 144
SER A 201
SER A 183
 None
None
None
NAP  A 301 (-3.3A)
 1.14A 2zw9B-4fdaA:
undetectable		 2zw9B-4fdaA:
18.19
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.
4hhr ALPHA-DIOXYGENASE

(Arabidopsis
thaliana) 		PF03098
(An_peroxidase) 		4 ILE A 320
ASN A 339
ARG A 566
TYR A 341
 None
None
CL  A 711 (-3.3A)
None
 1.05A 2zw9B-4hhrA:
undetectable		 2zw9B-4hhrA:
21.01
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.
4i5j SERINE/THREONINE-PRO
TEIN PHOSPHATASE 2A
REGULATORY SUBUNIT
B'' SUBUNIT ALPHA

(Homo sapiens) 		PF13499
(EF-hand_7) 		4 ILE A 249
ASN A 237
SER A 239
SER A 191
 None
 1.13A 2zw9B-4i5jA:
undetectable		 2zw9B-4i5jA:
18.46
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.
4iop C-TYPE LECTIN DOMAIN
FAMILY 2 MEMBER A
KILLER CELL
LECTIN-LIKE RECEPTOR
SUBFAMILY F MEMBER 2

(Homo sapiens;
Homo sapiens) 		PF00059
(Lectin_C)
PF00059
(Lectin_C) 		4 ILE A 140
ASN A 143
SER B 187
SER A 145
 None
 1.10A 2zw9B-4iopA:
undetectable		 2zw9B-4iopA:
11.90
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.
4iuy SHORT CHAIN
DEHYDROGENASE/REDUCT
ASE

(Acinetobacter
baumannii) 		PF00106
(adh_short) 		4 ILE A 144
ASN A 117
SER A 162
SER A 146
 None
 0.99A 2zw9B-4iuyA:
6.6		 2zw9B-4iuyA:
17.79
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.
4j0m SERINE/THREONINE-PRO
TEIN KINASE
BRI1-LIKE 1

(Arabidopsis
thaliana) 		PF08263
(LRRNT_2)
PF13516
(LRR_6)
PF13855
(LRR_8) 		4 ILE A 363
ASN A 344
SER A 370
SER A 366
 None
 1.10A 2zw9B-4j0mA:
undetectable		 2zw9B-4j0mA:
23.00
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.
4j1y COMPLEMENT C1S
SUBCOMPONENT

(Homo sapiens) 		PF00084
(Sushi)
PF00089
(Trypsin) 		4 ILE A 617
SER A 627
ARG A 572
SER A 654
 None
 1.14A 2zw9B-4j1yA:
undetectable		 2zw9B-4j1yA:
19.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4kvl FATTY ACID
ALPHA-OXIDASE

(Oryza sativa) 		PF03098
(An_peroxidase) 		4 ILE A 313
ASN A 332
ARG A 559
TYR A 334
 None
PLM  A 702 ( 3.6A)
PLM  A 702 (-2.9A)
None
 1.02A 2zw9B-4kvlA:
undetectable		 2zw9B-4kvlA:
21.27
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.
4le4 BETA-GLUCANASE

(Podospora
anserina) 		no annotation 4 ASN A 182
SER A 199
ASP A  73
SER A 257
 None
 0.95A 2zw9B-4le4A:
undetectable		 2zw9B-4le4A:
15.77
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.
4n8g TRAP DICARBOXYLATE
TRANSPORTER, DCTP
SUBUNIT

(Chromohalobacter
salexigens) 		PF03480
(DctP) 		4 ILE A 106
SER A 241
ASP A 180
SER A  95
 None
DAL  A 402 (-2.8A)
None
DAL  A 403 ( 4.7A)
 1.03A 2zw9B-4n8gA:
undetectable		 2zw9B-4n8gA:
19.06
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.
4oya ADENYLATE CYCLASE
TYPE 10

(Homo sapiens) 		PF00211
(Guanylate_cyc) 		4 ILE A 407
ASN A 412
ARG A 176
SER A  49
 None
None
1VE  A 501 (-3.2A)
None
 1.04A 2zw9B-4oyaA:
undetectable		 2zw9B-4oyaA:
21.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4pdx PUTATIVE
ALKYL/ARYL-SULFATASE
YJCS

(Escherichia
coli) 		PF00753
(Lactamase_B)
PF14863
(Alkyl_sulf_dimr)
PF14864
(Alkyl_sulf_C) 		4 ILE A 396
ASN A 394
ARG A 477
SER A 420
 None
 1.13A 2zw9B-4pdxA:
undetectable		 2zw9B-4pdxA:
22.66
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.
4rkm MCCA

(Wolinella
succinogenes) 		no annotation 4 ASN A 104
SER A 107
ARG A 112
SER A 120
 None
 1.00A 2zw9B-4rkmA:
undetectable		 2zw9B-4rkmA:
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.
4tvo MALATE DEHYDROGENASE

(Mycobacterium
tuberculosis) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		4 ILE A 282
ASN A 188
SER A 313
SER A 284
 None
 1.03A 2zw9B-4tvoA:
4.4		 2zw9B-4tvoA:
20.26
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.
4yzf FAB FRAGMENT OF
IMMUNOGLOBULIN (IGG)
MOLECULE

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		4 ILE E  84
SER E  72
TYR E  95
SER E  19
 None
 1.09A 2zw9B-4yzfE:
undetectable		 2zw9B-4yzfE:
14.22
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.
4za2 2-DEOXY-D-GLUCONATE
3-DEHYDROGENASE

(Pectobacterium
carotovorum) 		PF13561
(adh_short_C2) 		4 ILE A 143
ASN A 116
SER A 161
SER A 145
 None
 1.15A 2zw9B-4za2A:
5.9		 2zw9B-4za2A:
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.
4zo4 DEPHOSPHO-COA KINASE

(Campylobacter
jejuni) 		PF01121
(CoaE) 		4 ILE A  21
ASN A  23
SER A  29
SER A  16
 None
 0.99A 2zw9B-4zo4A:
undetectable		 2zw9B-4zo4A:
15.01
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.
5ao8 SOLUBLE LYTIC
TRANGLYCOSILASE B3

(Pseudomonas
aeruginosa) 		PF01471
(PG_binding_1)
PF13406
(SLT_2) 		4 ILE A 324
ASN A 328
ARG A  95
SER A 331
 None
NAG  A 999 (-4.0A)
None
None
 1.12A 2zw9B-5ao8A:
undetectable		 2zw9B-5ao8A:
19.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5b4x REELIN

(Mus musculus) 		PF07974
(EGF_2) 		4 ASN A2317
SER A2319
ASP A2168
SER A2222
 NAG  A4005 (-1.9A)
NAG  A4005 (-3.2A)
NAG  A4005 (-4.0A)
None
 1.15A 2zw9B-5b4xA:
undetectable		 2zw9B-5b4xA:
20.93
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.
5cyk RIBOSOME BIOGENESIS
PROTEIN YTM1

(Chaetomium
thermophilum) 		PF00400
(WD40)
PF08154
(NLE) 		4 ILE A 100
SER A 403
ARG A 419
SER A  98
 None
 1.00A 2zw9B-5cykA:
7.9		 2zw9B-5cykA:
22.68
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.
5e6s INTEGRIN ALPHA-L

(Homo sapiens) 		PF00092
(VWA)
PF01839
(FG-GAP)
PF08441
(Integrin_alpha2) 		4 ILE A 126
ASN A 129
SER A 165
ASP A  95
 None
 1.09A 2zw9B-5e6sA:
1.4		 2zw9B-5e6sA:
21.93
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.
5gwt 4-HYDROXYISOLECUINE
DEHYDROGENASE

(Bacillus
thuringiensis) 		no annotation 4 ILE A 135
ASN A 108
SER A 153
SER A 137
 NAD  A 301 (-4.3A)
None
None
SIN  A 302 ( 2.4A)
 1.14A 2zw9B-5gwtA:
5.5		 2zw9B-5gwtA:
18.05
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.
5gz4 SNAKE VENOM
PHOSPHODIESTERASE
(PDE)

(Naja atra) 		PF01033
(Somatomedin_B)
PF01223
(Endonuclease_NS)
PF01663
(Phosphodiest) 		4 ILE A 722
ASN A 583
SER A 579
SER A 607
 None
 1.07A 2zw9B-5gz4A:
undetectable		 2zw9B-5gz4A:
21.38
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.
5ifz RIBOSE 5-PHOSPHATE
ISOMERASE

(Brucella
melitensis) 		PF02502
(LacAB_rpiB) 		4 ILE A 117
ASN A 112
SER A 111
SER A 104
 None
 1.02A 2zw9B-5ifzA:
undetectable		 2zw9B-5ifzA:
12.64
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.
5jkq PFVFT1

(Plasmodium
falciparum) 		no annotation 4 ILE A 274
SER A 288
ASP A  61
SER A 272
 None
 1.13A 2zw9B-5jkqA:
undetectable		 2zw9B-5jkqA:
18.89
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.
5k8g ANTIFREEZE PROTEIN

(Marinomonas
primoryensis) 		no annotation 4 ILE A  19
SER A 107
ASP A  16
SER A 103
 None
None
CA  A 609 (-2.9A)
CA  A 610 ( 4.8A)
 1.09A 2zw9B-5k8gA:
undetectable		 2zw9B-5k8gA:
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.
5m5p PRE-MRNA-SPLICING
HELICASE BRR2

(Saccharomyces
cerevisiae) 		PF00270
(DEAD)
PF00271
(Helicase_C)
PF02889
(Sec63) 		4 ILE A1763
ASN A1755
SER A1854
SER A1761
 None
 1.11A 2zw9B-5m5pA:
3.2		 2zw9B-5m5pA:
17.15
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.
5mln ALCOHOL
DEHYDROGENASE 3

([Candida]
magnoliae) 		no annotation 4 ILE A 142
ASN A 113
SER A 160
SER A 144
 NAP  A 301 (-4.6A)
None
None
NAP  A 301 (-3.5A)
 1.13A 2zw9B-5mlnA:
5.2		 2zw9B-5mlnA:
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.
5o98 ALCOHOL
DEHYDROGENASE 1

(Catharanthus
roseus) 		no annotation 4 ILE A 165
ASN A 139
SER A 226
SER A 167
 NAP  A 501 (-4.4A)
None
None
NAP  A 501 ( 4.3A)
 1.16A 2zw9B-5o98A:
5.5		 2zw9B-5o98A:
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.
5t8u LIPOATE-PROTEIN
LIGASE 1

(Plasmodium
falciparum) 		PF03099
(BPL_LplA_LipB)
PF10437
(Lip_prot_lig_C) 		4 ILE A  32
ASN A  29
SER A  27
SER A  37
 None
 1.14A 2zw9B-5t8uA:
undetectable		 2zw9B-5t8uA:
20.32
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.
5thw DEACYLASE

(Burkholderia
multivorans) 		PF01546
(Peptidase_M20) 		4 ILE A 137
SER A 153
ASP A  98
SER A  95
 None
None
None
ZN  A 501 ( 4.9A)
 1.12A 2zw9B-5thwA:
undetectable		 2zw9B-5thwA:
20.33
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.
5tpc BOTULINUM NEUROTOXIN
TYPE A

(Clostridium
botulinum) 		PF07951
(Toxin_R_bind_C)
PF07953
(Toxin_R_bind_N) 		4 ILE A 878
ASN A1073
SER A 944
ASP A 875
 None
 1.12A 2zw9B-5tpcA:
undetectable		 2zw9B-5tpcA:
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.
5w11 GLUCANASE

(Thermothelomyces
thermophila) 		no annotation 4 ILE A 371
ASN A 220
LYS A 277
SER A 418
 None
 1.06A 2zw9B-5w11A:
undetectable		 2zw9B-5w11A:
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.
5y31 DISINTEGRIN AND
METALLOPROTEINASE
DOMAIN-CONTAINING
PROTEIN 22

(Homo sapiens) 		no annotation 4 ILE A 707
ASN A 712
SER A 689
SER A 709
 None
 0.92A 2zw9B-5y31A:
undetectable		 2zw9B-5y31A:
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.
5ys6 PRV GLYCOPROTEN B

(Suid
alphaherpesvirus
1) 		no annotation 4 ASN A 354
ARG A 373
TYR A 325
SER A 309
 None
 1.15A 2zw9B-5ys6A:
undetectable		 2zw9B-5ys6A:
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.
5z8o CYCLASE/DEHYDRASE

(Mycolicibacterium
smegmatis) 		no annotation 4 ILE A  73
ASN A  71
TYR A  67
SER A  16
 None
 1.11A 2zw9B-5z8oA:
undetectable		 2zw9B-5z8oA:
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.
6bu3 BETA-LACTAMASE

(Escherichia
coli) 		no annotation 4 ILE A 247
SER A 130
TYR A 264
SER A  72
 None
3GK  A 301 (-2.7A)
None
None
 0.93A 2zw9B-6bu3A:
undetectable		 2zw9B-6bu3A:
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.
6d9y SHORT-CHAIN
DEHYDROGENASE/REDUCT
ASE SDR

(Paraburkholderia
phymatum) 		no annotation 4 ILE A 142
ASN A 116
SER A 160
SER A 144
 None
 1.09A 2zw9B-6d9yA:
6.4		 2zw9B-6d9yA:
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.
6f5o POLYMERASE BASIC
PROTEIN 2

(Influenza B
virus) 		no annotation 4 ILE C 269
SER C 524
ASP C 307
SER C 520
 None
 1.12A 2zw9B-6f5oC:
undetectable		 2zw9B-6f5oC:
undetectable