SIMILAR PATTERNS OF AMINO ACIDS FOR 2WD9_C_IBPC1570_1

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.
1b65 PROTEIN
(AMINOPEPTIDASE)

(Ochrobactrum
anthropi) 		PF03576
(Peptidase_S58) 		5 THR A  41
LEU A 150
VAL A 356
GLY A 193
THR A 184
 None
 1.22A 2wd9C-1b65A:
undetectable		 2wd9C-1b65A:
21.96
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.
1c4x PROTEIN
(2-HYDROXY-6-OXO-6-P
HENYLHEXA-2,4-DIENOA
TE HYDROLASE)

(Rhodococcus
jostii) 		PF12697
(Abhydrolase_6) 		5 THR A  15
ILE A  66
LEU A  65
VAL A 115
GLY A  86
 None
 1.01A 2wd9C-1c4xA:
3.8		 2wd9C-1c4xA:
19.76
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.
1d6n PROTEIN
(HYPOXANTHINE-GUANIN
E
PHOSPHORIBOSYLTRANSF
ERASE)

(Homo sapiens) 		PF00156
(Pribosyltran) 		5 ILE A  41
LEU A  40
VAL A   7
GLY A 179
THR A  45
 None
 1.14A 2wd9C-1d6nA:
4.4		 2wd9C-1d6nA:
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.
1gpe PROTEIN (GLUCOSE
OXIDASE)

(Penicillium
amagasakiense) 		PF00732
(GMC_oxred_N)
PF05199
(GMC_oxred_C) 		5 THR A  38
ILE A 551
LEU A 291
GLY A 294
GLY A 553
 None
None
None
FAD  A 600 ( 3.8A)
FAD  A 600 (-3.6A)
 1.16A 2wd9C-1gpeA:
undetectable		 2wd9C-1gpeA:
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.
1m22 PEPTIDE AMIDASE

(Stenotrophomonas
maltophilia) 		PF01425
(Amidase) 		5 THR A 318
LEU A 329
VAL A 496
GLY A 497
GLY A 456
 None
 1.09A 2wd9C-1m22A:
undetectable		 2wd9C-1m22A:
21.98
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.
1mzb FERRIC UPTAKE
REGULATION PROTEIN

(Pseudomonas
aeruginosa) 		PF01475
(FUR) 		5 THR A  15
ILE A  21
LEU A  25
VAL A  67
ARG A  18
 None
 1.11A 2wd9C-1mzbA:
undetectable		 2wd9C-1mzbA:
14.41
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.
1mzb FERRIC UPTAKE
REGULATION PROTEIN

(Pseudomonas
aeruginosa) 		PF01475
(FUR) 		5 THR A  15
ILE A  21
VAL A  67
GLN A  60
ARG A  18
 None
 1.06A 2wd9C-1mzbA:
undetectable		 2wd9C-1mzbA:
14.41
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.
1nnl L-3-PHOSPHOSERINE
PHOSPHATASE

(Homo sapiens) 		PF00702
(Hydrolase) 		5 THR A 182
ILE A 108
LEU A 107
VAL A 116
GLY A 111
 None
None
None
None
CL  A1505 (-3.5A)
 1.25A 2wd9C-1nnlA:
4.0		 2wd9C-1nnlA:
15.71
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.
1npm NEUROPSIN

(Mus musculus) 		PF00089
(Trypsin) 		5 ILE A  41
LEU A  33
GLY A 196
GLY A 193
GLN A 192
 None
 1.12A 2wd9C-1npmA:
undetectable		 2wd9C-1npmA:
16.87
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.
1ry2 ACETYL-COENZYME A
SYNTHETASE 1

(Saccharomyces
cerevisiae) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C)
PF16177
(ACAS_N) 		6 THR A 320
ILE A 366
VAL A 442
GLY A 443
GLN A 471
THR A 472
 AMP  A 720 ( 4.8A)
AMP  A 720 (-4.9A)
AMP  A 720 ( 4.7A)
AMP  A 720 (-3.9A)
AMP  A 720 (-4.4A)
AMP  A 720 (-3.6A)
 0.90A 2wd9C-1ry2A:
41.7		 2wd9C-1ry2A:
29.24
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.
1sv6 2-KETO-4-PENTENOATE
HYDRATASE

(Escherichia
coli) 		PF01557
(FAA_hydrolase) 		5 ILE A 108
VAL A 255
GLY A 167
GLY A 253
GLN A 171
 None
 0.92A 2wd9C-1sv6A:
undetectable		 2wd9C-1sv6A:
18.36
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.
1tnd TRANSDUCIN

(Bos taurus) 		PF00503
(G-alpha) 		5 THR A  44
ILE A 220
LEU A  35
GLY A 198
GLY A  38
 GSP  A 351 (-3.8A)
None
None
GSP  A 351 (-3.6A)
GSP  A 351 ( 3.8A)
 1.17A 2wd9C-1tndA:
undetectable		 2wd9C-1tndA:
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.
1txo PUTATIVE BACTERIAL
ENZYME

(Mycobacterium
tuberculosis) 		PF13672
(PP2C_2) 		5 ILE A 116
LEU A 101
VAL A  53
GLY A  80
ARG A  78
 None
 1.28A 2wd9C-1txoA:
undetectable		 2wd9C-1txoA:
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.
1uj2 URIDINE-CYTIDINE
KINASE 2

(Homo sapiens) 		PF00485
(PRK) 		5 LEU A 133
VAL A  25
GLY A  24
GLY A 136
GLN A  61
 None
 1.26A 2wd9C-1uj2A:
undetectable		 2wd9C-1uj2A:
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.
1v5f PYRUVATE OXIDASE

(Aerococcus
viridans) 		PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N) 		5 THR A 290
ILE A 237
GLY A 215
GLY A 240
THR A 257
 None
None
FAD  A1601 (-2.9A)
FAD  A1601 (-3.6A)
None
 1.28A 2wd9C-1v5fA:
5.2		 2wd9C-1v5fA:
23.46
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.
1w8o BACTERIAL SIALIDASE

(Micromonospora
viridifaciens) 		PF00754
(F5_F8_type_C)
PF10633
(NPCBM_assoc)
PF13088
(BNR_2) 		5 VAL A 425
GLY A 465
GLY A 452
GLN A 451
THR A 468
 None
 1.29A 2wd9C-1w8oA:
undetectable		 2wd9C-1w8oA:
22.33
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.
1xhl SHORT-CHAIN
DEHYDROGENASE/REDUCT
ASE FAMILY MEMBER
(5L265), PUTATIVE
TROPINONE
REDUCTASE-II

(Caenorhabditis
elegans) 		PF13561
(adh_short_C2) 		5 ILE A 141
LEU A 178
GLY A 182
GLY A 139
ARG A 184
 None
 1.23A 2wd9C-1xhlA:
4.1		 2wd9C-1xhlA:
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.
1xkq SHORT-CHAIN
REDUCTASE FAMILY
MEMBER (5D234)

(Caenorhabditis
elegans) 		PF13561
(adh_short_C2) 		5 ILE A 143
LEU A 180
GLY A 184
GLY A 141
ARG A 186
 None
 1.26A 2wd9C-1xkqA:
4.2		 2wd9C-1xkqA:
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.
2cev PROTEIN (ARGINASE)

([Bacillus]
caldovelox) 		PF00491
(Arginase) 		5 ILE A 211
LEU A 214
VAL A 221
GLY A 220
GLN A 262
 None
 1.06A 2wd9C-2cevA:
undetectable		 2wd9C-2cevA:
20.88
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.
2co7 SAFA PILUS SUBUNIT

(Salmonella
enterica) 		PF09460
(Saf-Nte_pilin) 		5 THR A 122
ILE A 119
LEU A 117
VAL A  59
GLY A  61
 None
 1.16A 2wd9C-2co7A:
undetectable		 2wd9C-2co7A:
12.89
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.
2cv6 SEED STORAGE PROTEIN

(Vigna radiata) 		PF00190
(Cupin_1) 		5 ILE A  99
LEU A 100
VAL A  80
GLY A 103
GLY A  83
 None
 1.25A 2wd9C-2cv6A:
undetectable		 2wd9C-2cv6A:
21.98
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.
2dm8 INAD-LIKE PROTEIN

(Homo sapiens) 		PF00595
(PDZ) 		5 ILE A  23
LEU A  62
VAL A  50
GLY A  31
ARG A  58
 None
 1.27A 2wd9C-2dm8A:
undetectable		 2wd9C-2dm8A:
12.15
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.
2f2l PEPTIDOGLYCAN-RECOGN
ITION PROTEIN-LC
ISOFORM LCA

(Drosophila
melanogaster) 		PF01510
(Amidase_2) 		5 ILE A 381
LEU A 451
VAL A 377
GLY A 378
ARG A 490
 None
 1.03A 2wd9C-2f2lA:
undetectable		 2wd9C-2f2lA:
16.81
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.
2f9y ACETYL-COA
CARBOXYLASE,
CARBOXYLTRANSFERASE
ALPHA CHAIN

(Escherichia
coli) 		PF03255
(ACCA) 		5 ILE A 253
VAL A 199
GLY A 201
GLY A 203
ARG A  68
 None
 1.24A 2wd9C-2f9yA:
undetectable		 2wd9C-2f9yA:
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.
2f9y ACETYL-COA
CARBOXYLASE,
CARBOXYLTRANSFERASE
ALPHA CHAIN

(Escherichia
coli) 		PF03255
(ACCA) 		5 ILE A 253
VAL A 199
GLY A 201
GLY A 204
ARG A  68
 None
 1.06A 2wd9C-2f9yA:
undetectable		 2wd9C-2f9yA:
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.
2fu4 FERRIC UPTAKE
REGULATION PROTEIN

(Escherichia
coli) 		PF01475
(FUR) 		5 THR A  16
ILE A  22
LEU A  26
VAL A  68
ARG A  19
 None
 1.06A 2wd9C-2fu4A:
undetectable		 2wd9C-2fu4A:
10.99
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.
2jeo URIDINE-CYTIDINE
KINASE 1

(Homo sapiens) 		PF00485
(PRK) 		5 LEU A 136
VAL A  28
GLY A  27
GLY A 139
GLN A  64
 None
 1.22A 2wd9C-2jeoA:
undetectable		 2wd9C-2jeoA:
19.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ma4 PUTATIVE PERIPLASMIC
PROTEIN

(Salmonella
enterica) 		PF07338
(DUF1471) 		5 GLY A  83
GLY A  75
GLN A  76
THR A  77
ARG A  55
 None
 1.11A 2wd9C-2ma4A:
undetectable		 2wd9C-2ma4A:
9.40
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.
2o0x 3-PHOSPHOSHIKIMATE
1-CARBOXYVINYLTRANSF
ERASE

(Mycobacterium
tuberculosis) 		PF00275
(EPSP_synthase) 		5 ILE A 352
LEU A 355
VAL A 400
GLY A 394
GLY A 390
 None
 1.25A 2wd9C-2o0xA:
undetectable		 2wd9C-2o0xA:
21.86
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.
2p2m ACETYL-COENZYME A
SYNTHETASE

(Salmonella
enterica) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C)
PF16177
(ACAS_N) 		6 THR A 264
VAL A 386
GLY A 387
GLN A 415
THR A 416
ARG A 526
 PRX  A 998 ( 4.9A)
None
PRX  A 998 (-3.4A)
PRX  A 998 (-3.9A)
PRX  A 998 (-3.7A)
PRX  A 998 (-3.9A)
 0.66A 2wd9C-2p2mA:
41.0		 2wd9C-2p2mA:
26.67
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.
2q7x UPF0052 PROTEIN
SP_1565

(Streptococcus
pneumoniae) 		PF01933
(UPF0052) 		5 THR A 180
ILE A 187
LEU A 189
GLY A  10
THR A   7
 None
 1.28A 2wd9C-2q7xA:
4.5		 2wd9C-2q7xA:
20.65
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.
2qw8 EUGENOL SYNTHASE 1

(Ocimum
basilicum) 		PF05368
(NmrA) 		5 THR A 147
ILE A  80
LEU A  11
VAL A  76
ARG A 106
 None
 1.14A 2wd9C-2qw8A:
2.3		 2wd9C-2qw8A:
18.56
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.
2r5f TRANSCRIPTIONAL
REGULATOR, PUTATIVE

(Pseudomonas
syringae group
genomosp. 3) 		PF04198
(Sugar-bind) 		5 THR A 311
ILE A  96
GLY A 212
GLY A 282
THR A 307
 None
None
SO4  A   1 ( 3.8A)
None
None
 1.27A 2wd9C-2r5fA:
3.4		 2wd9C-2r5fA:
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.
2w57 FERRIC UPTAKE
REGULATION PROTEIN

(Vibrio cholerae) 		PF01475
(FUR) 		5 THR A  16
ILE A  22
VAL A  68
GLN A  61
ARG A  19
 None
 1.11A 2wd9C-2w57A:
undetectable		 2wd9C-2w57A:
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.
2xzi EXTRACELLULAR
SIALIDASE/NEURAMINID
ASE, PUTATIVE

(Aspergillus
fumigatus) 		PF13088
(BNR_2) 		5 ILE A 228
LEU A 218
VAL A 128
GLY A 210
ARG A 262
 NO2  A 505 ( 4.6A)
None
None
None
None
 1.27A 2wd9C-2xziA:
undetectable		 2wd9C-2xziA:
20.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2xzl ATP-DEPENDENT
HELICASE NAM7

(Saccharomyces
cerevisiae) 		PF09416
(UPF1_Zn_bind)
PF13086
(AAA_11)
PF13087
(AAA_12) 		5 THR A 439
ILE A 632
LEU A 427
GLY A 597
GLY A 430
 None
1PE  A1866 ( 4.0A)
1PE  A1864 (-4.2A)
None
None
 1.10A 2wd9C-2xzlA:
undetectable		 2wd9C-2xzlA:
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.
3d1j GLYCOGEN SYNTHASE

(Escherichia
coli) 		PF00534
(Glycos_transf_1)
PF08323
(Glyco_transf_5) 		5 THR A 398
LEU A 371
VAL A 310
GLY A 306
ARG A 396
 None
 1.10A 2wd9C-3d1jA:
4.3		 2wd9C-3d1jA:
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.
3dhv D-ALANINE-POLY(PHOSP
HORIBITOL) LIGASE

(Bacillus cereus) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C) 		5 THR A 152
LEU A 198
GLY A 270
GLY A 295
THR A 297
 None
DAL  A 701 ( 4.1A)
DAL  A 701 ( 3.1A)
AMP  A 711 ( 4.7A)
AMP  A 711 (-3.9A)
 0.63A 2wd9C-3dhvA:
37.2		 2wd9C-3dhvA:
26.82
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.
3e7w D-ALANINE--POLY(PHOS
PHORIBITOL) LIGASE
SUBUNIT 1

(Bacillus
subtilis) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C) 		6 THR A 151
LEU A 197
GLY A 269
GLY A 294
THR A 296
ARG A 407
 None
None
AMP  A 513 (-3.5A)
AMP  A 513 (-4.9A)
AMP  A 513 (-4.0A)
AMP  A 513 (-3.8A)
 1.01A 2wd9C-3e7wA:
40.1		 2wd9C-3e7wA:
25.77
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.
3il4 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 3

(Enterococcus
faecalis) 		PF08541
(ACP_syn_III_C)
PF08545
(ACP_syn_III) 		5 THR A 281
ILE A 286
LEU A 290
VAL A 169
GLY A 168
 None
None
None
CSO  A  13 ( 3.6A)
None
 1.27A 2wd9C-3il4A:
undetectable		 2wd9C-3il4A:
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.
3imk PUTATIVE MOLYBDENUM
CARRIER PROTEIN

(Syntrophus
aciditrophicus) 		PF12694
(MoCo_carrier) 		5 THR A  66
ILE A  78
LEU A  77
GLY A  75
THR A  91
 GOL  A 158 ( 4.2A)
None
None
None
GOL  A 158 (-4.4A)
 1.23A 2wd9C-3imkA:
3.9		 2wd9C-3imkA:
14.74
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.
3lgx D-ALANINE--POLY(PHOS
PHORIBITOL) LIGASE
SUBUNIT 1

(Streptococcus
pyogenes) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C) 		5 THR A 148
LEU A 196
GLY A 268
GLY A 293
THR A 295
 ATP  A 600 (-3.7A)
None
ATP  A 600 (-3.4A)
ATP  A 600 ( 4.8A)
ATP  A 600 (-3.6A)
 0.86A 2wd9C-3lgxA:
39.8		 2wd9C-3lgxA:
26.24
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.
3lwk BETA-CRYSTALLIN A4

(Homo sapiens) 		PF00030
(Crystall) 		5 ILE A  68
LEU A  69
VAL A  49
GLY A  72
GLN A 195
 None
 1.18A 2wd9C-3lwkA:
undetectable		 2wd9C-3lwkA:
15.61
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.
3m6j UNCHARACTERIZED
PROTEIN

(Leptospirillum
rubarum) 		no annotation 5 ILE A 130
LEU A 127
VAL A 123
GLY A 122
GLY A  33
 None
None
None
CL  A 201 (-3.6A)
None
 1.13A 2wd9C-3m6jA:
undetectable		 2wd9C-3m6jA:
13.74
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.
3nx3 ACETYLORNITHINE
AMINOTRANSFERASE

(Campylobacter
jejuni) 		PF00202
(Aminotran_3) 		5 ILE A 214
LEU A 215
GLY A 125
GLN A 126
THR A 180
 None
 1.14A 2wd9C-3nx3A:
4.4		 2wd9C-3nx3A:
20.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3pp8 GLYOXYLATE/HYDROXYPY
RUVATE REDUCTASE A

(Salmonella
enterica) 		PF02826
(2-Hacid_dh_C) 		5 ILE A 207
GLY A 180
GLN A 203
THR A 204
ARG A 167
 None
 1.18A 2wd9C-3pp8A:
5.9		 2wd9C-3pp8A:
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.
3rko NADH-QUINONE
OXIDOREDUCTASE
SUBUNIT J
NADH-QUINONE
OXIDOREDUCTASE
SUBUNIT K

(Escherichia
coli) 		no annotation 5 THR J 132
ILE J 124
GLY K  54
GLN K  55
THR K  56
 None
 1.14A 2wd9C-3rkoJ:
undetectable		 2wd9C-3rkoJ:
14.94
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.
3w36 NAPH1

(Streptomyces
sp. CNQ525) 		no annotation 5 THR A  89
ILE A 366
GLY A 197
GLN A 265
THR A 266
 None
 0.96A 2wd9C-3w36A:
undetectable		 2wd9C-3w36A:
19.90
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.
3wv4 NON-RIBOSOMAL
PEPTIDE SYNTHETASE

(Streptomyces
halstedii) 		PF00501
(AMP-binding) 		5 THR A 185
TRP A 229
GLY A 325
GLN A 326
THR A 327
 None
 0.96A 2wd9C-3wv4A:
42.3		 2wd9C-3wv4A:
27.94
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.
3wvn NON-RIBOSOMAL
PEPTIDE SYNTHETASE

(Streptomyces
halstedii) 		PF00501
(AMP-binding) 		5 THR A 185
TRP A 229
GLY A 325
GLN A 326
THR A 327
 None
ASP  A 601 ( 4.9A)
ASP  A 601 (-3.6A)
None
ASP  A 601 (-4.6A)
 1.04A 2wd9C-3wvnA:
42.6		 2wd9C-3wvnA:
28.26
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.
4avo BETA-1,4-EXOCELLULAS
E

(Thermobifida
fusca) 		PF01341
(Glyco_hydro_6) 		5 ILE A 424
LEU A 423
GLY A 421
GLY A 483
GLN A 405
 None
None
CA  A 607 ( 4.9A)
None
None
 1.20A 2wd9C-4avoA:
undetectable		 2wd9C-4avoA:
20.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4d4g APNAA1

(Planktothrix
agardhii) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C) 		5 THR A 155
GLY A 274
GLY A 300
THR A 302
ARG A 420
 ANP  A1489 (-3.3A)
ANP  A1489 ( 3.3A)
GOL  A1490 (-3.9A)
ANP  A1489 ( 3.6A)
ANP  A1489 (-3.8A)
 0.61A 2wd9C-4d4gA:
42.9		 2wd9C-4d4gA:
28.17
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.
4d7e L-LYS MONOOXYGENASE

(Nocardia
farcinica) 		PF13434
(K_oxygenase) 		5 LEU A 165
VAL A  36
GLY A 135
THR A 162
ARG A 138
 None
 1.12A 2wd9C-4d7eA:
undetectable		 2wd9C-4d7eA:
22.85
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.
4f4f THREONINE SYNTHASE

(Brucella
melitensis) 		PF00291
(PALP)
PF14821
(Thr_synth_N) 		5 THR A 304
ILE A 372
LEU A 383
VAL A 391
GLY A 390
 None
 1.11A 2wd9C-4f4fA:
undetectable		 2wd9C-4f4fA:
23.26
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.
4gl0 LMO0810 PROTEIN

(Listeria
monocytogenes) 		PF13416
(SBP_bac_8) 		5 TRP A 158
LEU A 182
VAL A 234
GLY A 142
THR A 157
 None
 1.29A 2wd9C-4gl0A:
undetectable		 2wd9C-4gl0A:
19.79
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.
4hkm ANTHRANILATE
PHOSPHORIBOSYLTRANSF
ERASE

(Xanthomonas
campestris) 		PF00591
(Glycos_transf_3)
PF02885
(Glycos_trans_3N) 		5 THR A  92
ILE A 293
LEU A 231
GLY A 224
GLY A 234
 None
 1.26A 2wd9C-4hkmA:
3.1		 2wd9C-4hkmA:
21.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ix1 HYPOTHETICAL PROTEIN

(Rhodococcus
opacus) 		no annotation 6 THR A  20
LEU A  30
VAL A  15
GLY A  16
GLY A  80
GLN A  81
 None
 1.42A 2wd9C-4ix1A:
3.4		 2wd9C-4ix1A:
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.
4j9u TRK SYSTEM POTASSIUM
UPTAKE PROTEIN TRKH

(Vibrio
parahaemolyticus) 		PF02386
(TrkH) 		5 THR A 242
ILE A 218
GLY A 353
GLY A 221
THR A 217
 None
None
None
K  A 504 (-3.5A)
None
 1.06A 2wd9C-4j9uA:
undetectable		 2wd9C-4j9uA:
21.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4m2g L-ARGININE
BETA-HYDROXYLASE

(Streptomyces
lavendulae) 		PF02668
(TauD) 		5 LEU A 106
VAL A 293
GLY A 170
GLY A 291
GLN A 290
 None
 1.12A 2wd9C-4m2gA:
undetectable		 2wd9C-4m2gA:
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.
4mrq PHOSPHOMANNOMUTASE/P
HOSPHOGLUCOMUTASE

(Pseudomonas
aeruginosa) 		PF00408
(PGM_PMM_IV)
PF02878
(PGM_PMM_I)
PF02879
(PGM_PMM_II)
PF02880
(PGM_PMM_III) 		5 ILE A  69
LEU A  72
VAL A 103
GLY A 102
GLY A  54
 None
 1.24A 2wd9C-4mrqA:
undetectable		 2wd9C-4mrqA:
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.
4nen INTEGRIN ALPHA-X

(Homo sapiens) 		PF00092
(VWA)
PF01839
(FG-GAP)
PF08441
(Integrin_alpha2) 		5 THR A 207
ILE A 143
VAL A 297
GLY A 268
GLY A 270
 MG  A1116 ( 2.9A)
None
None
None
None
 1.29A 2wd9C-4nenA:
4.1		 2wd9C-4nenA:
19.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4prk 4-PHOSPHOERYTHRONATE
DEHYDROGENASE

(Lactobacillus
jensenii) 		PF00389
(2-Hacid_dh)
PF02826
(2-Hacid_dh_C) 		5 LEU A  65
VAL A  48
GLY A  47
GLY A  74
THR A  94
 None
 1.25A 2wd9C-4prkA:
4.5		 2wd9C-4prkA:
21.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4rgg PUTATIVE PHAGE
STRUCTURAL PROTEIN

(Lactococcus
phage 1358) 		no annotation 5 ILE A 167
LEU A 150
VAL A  32
GLY A  31
ARG A 132
 None
 1.00A 2wd9C-4rggA:
undetectable		 2wd9C-4rggA:
22.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4rl8 PROTEIN INVOLVED IN
META-PATHWAY OF
PHENOL
DEGRADATION-LIKE
PROTEIN

(Pseudomonas
putida) 		PF13557
(Phenol_MetA_deg) 		5 ILE A  49
LEU A  70
VAL A  90
GLY A  91
GLY A  73
 None
None
C8E  A 309 (-4.8A)
None
None
 1.25A 2wd9C-4rl8A:
undetectable		 2wd9C-4rl8A:
19.12
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.
4ru5 TAILSPIKE GP27

(Pseudomonas
phage phi297) 		no annotation 5 ILE A 548
LEU A 494
GLY A 496
GLY A 524
GLN A 554
 None
 1.16A 2wd9C-4ru5A:
undetectable		 2wd9C-4ru5A:
21.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4yj5 PYRUVATE KINASE PKM

(Homo sapiens) 		PF00224
(PK)
PF02887
(PK_C) 		5 THR A 454
LEU A 512
GLY A 514
GLY A 520
THR A 432
 None
 1.27A 2wd9C-4yj5A:
undetectable		 2wd9C-4yj5A:
22.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4yqz PUTATIVE
OXIDOREDUCTASE

(Thermus
thermophilus) 		PF13561
(adh_short_C2) 		5 LEU A 111
VAL A 163
GLY A 120
GLY A 118
GLN A 117
 None
 1.21A 2wd9C-4yqzA:
3.0		 2wd9C-4yqzA:
22.46
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.
4ysh GLYCINE OXIDASE

(Geobacillus
kaustophilus) 		PF01266
(DAO) 		5 THR A 194
LEU A 174
GLY A  12
GLY A  36
THR A 178
 None
None
FAD  A 401 ( 4.8A)
None
None
 1.09A 2wd9C-4yshA:
undetectable		 2wd9C-4yshA:
23.39
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.
4zgs PUTATIVE D-LACTATE
DEHYDROGENASE

(Chlamydomonas
reinhardtii) 		PF00389
(2-Hacid_dh)
PF02826
(2-Hacid_dh_C) 		5 ILE A 196
LEU A 197
VAL A 183
GLY A 190
GLN A 191
 None
 1.26A 2wd9C-4zgsA:
3.7		 2wd9C-4zgsA:
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.
4zze SUGAR BINDING
PROTEIN OF ABC
TRANSPORTER SYSTEM

(Bifidobacterium
animalis) 		PF01547
(SBP_bac_1) 		5 THR A 313
ILE A 320
LEU A 321
GLY A 168
THR A 228
 None
 1.03A 2wd9C-4zzeA:
undetectable		 2wd9C-4zzeA:
20.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5axh DEXTRANASE

(Thermoanaerobacter
pseudethanolicus) 		PF13199
(Glyco_hydro_66) 		5 THR A 476
LEU A 173
GLY A 153
GLY A 180
ARG A 151
 None
 1.23A 2wd9C-5axhA:
undetectable		 2wd9C-5axhA:
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.
5c2v HYDRAZINE SYNTHASE
ALPHA SUBUNIT

(Candidatus
Kuenenia
stuttgartiensis) 		no annotation 5 TRP A 607
GLY A 580
GLY A 456
GLN A 548
THR A 546
 None
 1.15A 2wd9C-5c2vA:
undetectable		 2wd9C-5c2vA:
21.73
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.
5ccx TRNA
(ADENINE(58)-N(1))-M
ETHYLTRANSFERASE
CATALYTIC SUBUNIT
TRMT61A
TRNA
(ADENINE(58)-N(1))-M
ETHYLTRANSFERASE
NON-CATALYTIC
SUBUNIT TRM6

(Homo sapiens) 		PF04189
(Gcd10p)
PF08704
(GCD14) 		5 THR A  96
ILE A 125
GLY B 222
THR A 124
ARG B 220
 None
 1.06A 2wd9C-5ccxA:
4.6		 2wd9C-5ccxA:
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.
5cuv ACIDOCALCISOMAL
PYROPHOSPHATASE

(Trypanosoma
cruzi) 		PF00719
(Pyrophosphatase) 		5 ILE A 227
LEU A 273
VAL A 313
GLY A 311
GLN A 309
 None
 1.20A 2wd9C-5cuvA:
undetectable		 2wd9C-5cuvA:
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.
5dmh UNCHARACTERIZED
PROTEIN CONSERVED IN
BACTERIA

(Cupriavidus
necator) 		PF07005
(DUF1537)
PF17042
(DUF1357_C) 		5 THR A  97
VAL A 396
GLY A 395
GLY A 417
ARG A 133
 None
 1.09A 2wd9C-5dmhA:
undetectable		 2wd9C-5dmhA:
25.08
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.
5doo PROTEIN LYSINE
METHYLTRANSFERASE 2

(Rickettsia
typhi) 		PF10119
(MethyTransf_Reg)
PF13847
(Methyltransf_31) 		5 THR A  23
LEU A  48
VAL A  73
GLY A  72
GLY A  51
 None
 1.02A 2wd9C-5dooA:
undetectable		 2wd9C-5dooA:
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.
5e7q ACYL-COA SYNTHETASE

(Streptomyces
platensis) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C) 		5 THR A 171
ILE A 216
GLY A 312
GLN A 313
THR A 314
 None
 0.43A 2wd9C-5e7qA:
35.9		 2wd9C-5e7qA:
25.46
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.
5gxd AMP-DEPENDENT
SYNTHETASE AND
LIGASE

(Dinoroseobacter
shibae) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C)
PF16177
(ACAS_N) 		5 THR A 239
GLY A 365
GLN A 390
THR A 391
ARG A 504
 AMP  A 701 (-4.7A)
AMP  A 701 ( 3.3A)
AMP  A 701 (-4.3A)
AMP  A 701 (-3.6A)
AMP  A 701 ( 3.9A)
 0.43A 2wd9C-5gxdA:
41.6		 2wd9C-5gxdA:
26.86
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.
5ha4 DIAMINOPIMELATE
EPIMERASE

(Acinetobacter
baumannii) 		PF01678
(DAP_epimerase) 		5 ILE A  32
LEU A  35
VAL A  42
GLY A  43
GLN A  46
 None
 1.15A 2wd9C-5ha4A:
undetectable		 2wd9C-5ha4A:
18.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5i67 PHOSPHOENOLPYRUVATE
CARBOXYKINASE [GTP]

(Mycobacterium
tuberculosis) 		PF00821
(PEPCK_C)
PF17297
(PEPCK_N) 		5 ILE A 578
LEU A 577
VAL A 458
GLY A 444
THR A 442
 None
 1.10A 2wd9C-5i67A:
undetectable		 2wd9C-5i67A:
23.80
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.
5ik8 LAMININ SUBUNIT
ALPHA-2

(Mus musculus) 		PF00054
(Laminin_G_1)
PF02210
(Laminin_G_2) 		5 THR A2892
GLY A2884
GLY A2796
GLN A2813
THR A2899
 None
 1.24A 2wd9C-5ik8A:
undetectable		 2wd9C-5ik8A:
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.
5j6q CELL WALL BINDING
PROTEIN CWP8

(Clostridioides
difficile) 		PF04122
(CW_binding_2) 		5 ILE A 320
LEU A 321
VAL A 382
GLY A 323
GLY A 377
 None
 1.20A 2wd9C-5j6qA:
4.1		 2wd9C-5j6qA:
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.
5ja1 ENTEROBACTIN
SYNTHASE COMPONENT F

(Escherichia
coli) 		PF00501
(AMP-binding)
PF00550
(PP-binding)
PF00668
(Condensation)
PF00975
(Thioesterase)
PF13193
(AMP-binding_C) 		5 THR A 603
GLY A 723
GLY A 747
THR A 749
ARG A 866
 None
75C  A1301 (-3.4A)
75C  A1301 (-4.7A)
75C  A1301 (-4.5A)
75C  A1301 (-4.0A)
 0.51A 2wd9C-5ja1A:
41.0		 2wd9C-5ja1A:
18.52
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.
5k8f ACETYL-COENZYME A
SYNTHETASE

(Cryptococcus
neoformans) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C)
PF16177
(ACAS_N) 		5 THR A 289
ILE A 335
VAL A 411
GLY A 412
THR A 441
 ATP  A 703 (-3.8A)
None
ATP  A 703 (-4.8A)
ATP  A 703 ( 3.4A)
ATP  A 703 ( 3.7A)
 0.73A 2wd9C-5k8fA:
38.8		 2wd9C-5k8fA:
28.20
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.
5k8f ACETYL-COENZYME A
SYNTHETASE

(Cryptococcus
neoformans) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C)
PF16177
(ACAS_N) 		5 TRP A 334
ILE A 335
VAL A 411
GLY A 412
THR A 441
 6R9  A 704 ( 4.2A)
None
ATP  A 703 (-4.8A)
ATP  A 703 ( 3.4A)
ATP  A 703 ( 3.7A)
 0.58A 2wd9C-5k8fA:
38.8		 2wd9C-5k8fA:
28.20
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.
5l0p TRANSCRIPTION FACTOR
ETV6, TRANSCRIPTION
FACTOR ETV6,
TRANSCRIPTION FACTOR
ETV6, FERRIC UPTAKE
REGULATION PROTEIN
CHIMERA

(Homo sapiens;
Klebsiella
pneumoniae) 		PF01475
(FUR)
PF02198
(SAM_PNT) 		5 THR A 284
ILE A 290
LEU A 294
VAL A 336
ARG A 287
 None
 1.03A 2wd9C-5l0pA:
undetectable		 2wd9C-5l0pA:
23.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5l0p TRANSCRIPTION FACTOR
ETV6, TRANSCRIPTION
FACTOR ETV6,
TRANSCRIPTION FACTOR
ETV6, FERRIC UPTAKE
REGULATION PROTEIN
CHIMERA

(Homo sapiens;
Klebsiella
pneumoniae) 		PF01475
(FUR)
PF02198
(SAM_PNT) 		5 THR A 284
ILE A 290
VAL A 336
GLN A 329
ARG A 287
 None
 1.09A 2wd9C-5l0pA:
undetectable		 2wd9C-5l0pA:
23.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5n4a INTRAFLAGELLAR
TRANSPORT PROTEIN 80

(Chlamydomonas
reinhardtii) 		no annotation 5 ILE A 263
LEU A 265
VAL A 293
GLY A 285
GLY A 295
 None
 1.26A 2wd9C-5n4aA:
undetectable		 2wd9C-5n4aA:
10.60
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.
5o96 RIBOSOMAL RNA SMALL
SUBUNIT
METHYLTRANSFERASE E

(Legionella
pneumophila) 		no annotation 5 ILE A 231
LEU A 234
VAL A 106
GLY A 105
GLN A  99
 None
 1.18A 2wd9C-5o96A:
undetectable		 2wd9C-5o96A:
18.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5tzb D-AMINOPEPTIDASE

(Burkholderia
sp. LK4) 		PF03576
(Peptidase_S58) 		5 THR A  33
LEU A 133
VAL A 346
GLY A 176
THR A 167
 None
 1.25A 2wd9C-5tzbA:
undetectable		 2wd9C-5tzbA:
24.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5w1j THIOREDOXIN
GLUTATHIONE
REDUCTASE

(Echinococcus
granulosus) 		no annotation 5 LEU A 208
VAL A 157
GLY A 153
GLY A 151
ARG A 213
 None
 1.27A 2wd9C-5w1jA:
undetectable		 2wd9C-5w1jA:
23.14
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.
5wmm NRPS

(Micromonospora
sp. ML1) 		no annotation 5 THR A 170
GLY A 282
GLY A 307
THR A 309
ARG A 424
 None
B6G  A1001 (-3.4A)
B6G  A1001 (-4.8A)
B6G  A1001 (-3.8A)
B6G  A1001 (-4.0A)
 0.37A 2wd9C-5wmmA:
40.2		 2wd9C-5wmmA:
10.30
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.
5x8g 2-SUCCINYLBENZOATE--
COA LIGASE

(Bacillus
subtilis) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C) 		5 THR A 152
ILE A 197
GLY A 264
GLY A 287
THR A 289
 None
CA  A 505 ( 4.5A)
S0N  A 501 (-4.1A)
S0N  A 501 (-4.5A)
CA  A 505 (-3.3A)
 0.73A 2wd9C-5x8gA:
41.9		 2wd9C-5x8gA:
25.80
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.
5xhu FERREDOXIN--NADP
REDUCTASE

(Bacillus
subtilis) 		no annotation 5 THR A 124
ILE A  13
GLY A 105
GLY A  92
ARG A  89
 FAD  A1000 (-4.2A)
FAD  A1000 (-4.7A)
None
None
None
 1.04A 2wd9C-5xhuA:
2.6		 2wd9C-5xhuA:
9.88
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.
5xil PUTATIVE PROLYL-TRNA
SYNTHETASE

(Leishmania
major) 		no annotation 5 ILE A 682
LEU A 681
GLY A 471
THR A 675
ARG A 678
 None
 1.11A 2wd9C-5xilA:
2.1		 2wd9C-5xilA:
9.48
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.
5xtc NADH-UBIQUINONE
OXIDOREDUCTASE CHAIN
2

(Homo sapiens) 		no annotation 5 THR i 214
LEU i 249
GLY i 252
GLY i 259
THR i 333
 None
 1.13A 2wd9C-5xtci:
undetectable		 2wd9C-5xtci:
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.
5y9h SAFD,PUTATIVE OUTER
MEMBRANE
PROTEIN,PUTATIVE
OUTER MEMBRANE
PROTEIN,PUTATIVE
OUTER MEMBRANE
PROTEIN

(Salmonella
enterica) 		no annotation 5 THR A 273
ILE A 270
LEU A 198
VAL A 210
GLY A 212
 None
 1.17A 2wd9C-5y9hA:
undetectable		 2wd9C-5y9hA:
24.22
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.
5y9h SAFD,PUTATIVE OUTER
MEMBRANE
PROTEIN,PUTATIVE
OUTER MEMBRANE
PROTEIN,PUTATIVE
OUTER MEMBRANE
PROTEIN

(Salmonella
enterica) 		no annotation 5 THR A 273
ILE A 270
LEU A 268
VAL A 210
GLY A 212
 None
 1.03A 2wd9C-5y9hA:
undetectable		 2wd9C-5y9hA:
24.22