SIMILAR PATTERNS OF AMINO ACIDS FOR 4UYM_B_VORB590

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.
1a2v METHYLAMINE OXIDASE

(Ogataea angusta) 		PF01179
(Cu_amine_oxid)
PF02727
(Cu_amine_oxidN2)
PF02728
(Cu_amine_oxidN3) 		4 TYR A 176
ALA A 221
ILE A 428
PHE A 631
 None
 1.13A 4uymB-1a2vA:
0.0		 4uymB-1a2vA:
19.35
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.
1cs3 ZINC FINGER PROTEIN
PLZF

(Homo sapiens) 		PF00651
(BTB) 		4 PHE A  63
ILE A  83
LEU A  72
PHE A  80
 None
 1.09A 4uymB-1cs3A:
0.0		 4uymB-1cs3A:
12.24
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.
1i2o TRANSALDOLASE B

(Escherichia
coli) 		PF00923
(TAL_FSA) 		4 TYR A 212
TYR A 213
ALA A 170
ILE A 276
 None
 1.06A 4uymB-1i2oA:
0.0		 4uymB-1i2oA:
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.
1js4 ENDO/EXOCELLULASE E4

(Thermobifida
fusca) 		PF00759
(Glyco_hydro_9)
PF00942
(CBM_3) 		4 ALA A   9
ILE A 350
LEU A 402
PHE A 433
 None
 1.12A 4uymB-1js4A:
0.0		 4uymB-1js4A:
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.
1jsd HAEMAGGLUTININ (HA1
CHAIN)

(Influenza A
virus) 		PF00509
(Hemagglutinin) 		4 TYR A 185
TYR A 151
ALA A 243
ILE A 172
 None
 1.14A 4uymB-1jsdA:
0.0		 4uymB-1jsdA:
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.
1kkh MEVALONATE KINASE

(Methanocaldococcus
jannaschii) 		PF00288
(GHMP_kinases_N)
PF08544
(GHMP_kinases_C) 		4 ALA A 232
ILE A 180
LEU A 188
PHE A 184
 None
 0.99A 4uymB-1kkhA:
0.0		 4uymB-1kkhA:
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.
1l1p TRIGGER FACTOR

(Escherichia
coli) 		PF00254
(FKBP_C) 		4 PHE A  74
ILE A  92
LEU A  44
PHE A  42
 None
 0.95A 4uymB-1l1pA:
0.0		 4uymB-1l1pA:
18.06
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.
1o94 TRIMETHYLAMINE
DEHYDROGENASE

(Methylophilus
methylotrophus) 		PF00724
(Oxidored_FMN)
PF07992
(Pyr_redox_2) 		4 TYR A 539
ALA A 682
ILE A 346
LEU A 428
 None
None
SF4  A1732 (-4.5A)
None
 0.81A 4uymB-1o94A:
0.0		 4uymB-1o94A:
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.
1org PHEROMONE BINDING
PROTEIN

(Rhyparobia
maderae) 		PF01395
(PBP_GOBP) 		4 TYR A   5
ALA A  48
ILE A 107
LEU A  54
 GOL  A 251 (-4.8A)
None
None
None
 0.90A 4uymB-1orgA:
undetectable		 4uymB-1orgA:
13.36
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.
1qcx PECTIN LYASE B

(Aspergillus
niger) 		PF00544
(Pec_lyase_C) 		4 PHE A 261
ALA A 248
ILE A 191
LEU A 216
 None
 1.07A 4uymB-1qcxA:
0.0		 4uymB-1qcxA:
21.59
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.
1qyi HYPOTHETICAL PROTEIN

(Staphylococcus
aureus) 		PF13242
(Hydrolase_like) 		4 ALA A 150
ILE A  83
LEU A 137
PHE A 136
 None
 1.11A 4uymB-1qyiA:
undetectable		 4uymB-1qyiA:
22.65
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.
1rc7 RIBONUCLEASE III

(Aquifex
aeolicus) 		PF00035
(dsrm)
PF14622
(Ribonucleas_3_3) 		4 ALA A 142
ILE A  51
LEU A  83
PHE A  79
 None
 0.91A 4uymB-1rc7A:
undetectable		 4uymB-1rc7A:
19.35
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.
1rpt PROSTATIC ACID
PHOSPHATASE

(Rattus
norvegicus) 		PF00328
(His_Phos_2) 		4 PHE A  10
ALA A  84
ILE A 109
LEU A  91
 None
 0.86A 4uymB-1rptA:
0.4		 4uymB-1rptA:
22.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1s62 TOLA PROTEIN

(Escherichia
coli) 		PF06519
(TolA) 		4 PHE A  98
ALA A  20
LEU A  48
PHE A  91
 None
 0.99A 4uymB-1s62A:
undetectable		 4uymB-1s62A:
12.73
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.
1sq1 CHORISMATE SYNTHASE

(Campylobacter
jejuni) 		PF01264
(Chorismate_synt) 		4 ALA A 130
ILE A  25
LEU A 338
PHE A  10
 None
 1.13A 4uymB-1sq1A:
undetectable		 4uymB-1sq1A:
22.02
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.
1twy ABC TRANSPORTER,
PERIPLASMIC
SUBSTRATE-BINDING
PROTEIN

(Vibrio cholerae) 		PF12727
(PBP_like) 		4 ALA A  46
ILE A  79
LEU A 259
PHE A 255
 None
 1.03A 4uymB-1twyA:
undetectable		 4uymB-1twyA:
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.
1w0h 3'-5' EXONUCLEASE
ERI1

(Homo sapiens) 		PF00929
(RNase_T) 		4 PHE A 253
TYR A 250
ILE A 151
PHE A 154
 None
 0.97A 4uymB-1w0hA:
undetectable		 4uymB-1w0hA:
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.
1zbh 3'-5' EXONUCLEASE
ERI1

(Homo sapiens) 		PF00929
(RNase_T)
PF02037
(SAP) 		4 PHE A 253
TYR A 250
ILE A 151
PHE A 154
 None
 0.95A 4uymB-1zbhA:
undetectable		 4uymB-1zbhA:
20.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1zbu 3'-5' EXONUCLEASE
ERI1

(Homo sapiens) 		PF00929
(RNase_T) 		4 PHE A 253
TYR A 250
ILE A 151
PHE A 154
 None
 0.91A 4uymB-1zbuA:
undetectable		 4uymB-1zbuA:
20.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1zx2 UBP3-ASSOCIATED
PROTEIN BRE5

(Saccharomyces
cerevisiae) 		PF02136
(NTF2) 		4 TYR A  16
ALA A 102
ILE A 138
PHE A 116
 None
 1.07A 4uymB-1zx2A:
undetectable		 4uymB-1zx2A:
13.25
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.
2avt DNA POLYMERASE III
BETA SUBUNIT

(Streptococcus
pyogenes) 		PF00712
(DNA_pol3_beta)
PF02767
(DNA_pol3_beta_2)
PF02768
(DNA_pol3_beta_3) 		4 PHE A   4
ILE A  85
LEU A  77
PHE A  82
 None
 0.97A 4uymB-2avtA:
undetectable		 4uymB-2avtA:
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.
2fnc MALTOSE ABC
TRANSPORTER,
PERIPLASMIC
MALTOSE-BINDING
PROTEIN

(Thermotoga
maritima) 		PF13416
(SBP_bac_8) 		4 ALA A 289
ILE A  80
LEU A  86
PHE A  83
 None
 1.04A 4uymB-2fncA:
undetectable		 4uymB-2fncA:
21.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2fy2 CHOLINE
O-ACETYLTRANSFERASE

(Homo sapiens) 		PF00755
(Carn_acyltransf) 		4 TYR A 127
PHE A 310
LEU A 158
PHE A 327
 None
 1.12A 4uymB-2fy2A:
undetectable		 4uymB-2fy2A:
21.77
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.
2g5x RIBOSOME-INACTIVATIN
G PROTEIN

(Silene
chalcedonica) 		PF00161
(RIP) 		4 PHE A  16
ILE A 165
LEU A  61
PHE A  63
 None
 0.98A 4uymB-2g5xA:
undetectable		 4uymB-2g5xA:
21.97
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.
2gep SULFITE REDUCTASE
HEMOPROTEIN

(Escherichia
coli) 		PF01077
(NIR_SIR)
PF03460
(NIR_SIR_ferr) 		4 ALA A 383
ILE A  91
LEU A 398
PHE A 390
 None
 0.98A 4uymB-2gepA:
undetectable		 4uymB-2gepA:
23.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2hpa PROTEIN (ACID
PHOSPHATASE)

(Homo sapiens) 		PF00328
(His_Phos_2) 		4 PHE A1010
ALA A1084
ILE A1109
LEU A1091
 None
 0.89A 4uymB-2hpaA:
0.6		 4uymB-2hpaA:
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.
2l1l CAMP-DEPENDENT
PROTEIN KINASE
INHIBITOR ALPHA
EXPORTIN-1

(Homo sapiens) 		no annotation 4 PHE B 572
ALA B 541
ILE B 521
LEU A  14
 None
 1.09A 4uymB-2l1lB:
undetectable		 4uymB-2l1lB:
12.56
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.
2na0 GUANYLYL
CYCLASE-ACTIVATING
PROTEIN 1

(Bos taurus) 		PF00036
(EF-hand_1)
PF13499
(EF-hand_7) 		4 TYR A  99
PHE A  65
ILE A 119
LEU A 174
 None
 1.00A 4uymB-2na0A:
undetectable		 4uymB-2na0A:
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.
2nq5 5-METHYLTETRAHYDROPT
EROYLTRIGLUTAMATE--H
OMOCYSTEINE
METHYLTRANSFERASE

(Streptococcus
mutans) 		PF01717
(Meth_synt_2)
PF08267
(Meth_synt_1) 		4 TYR A 606
ALA A 613
ILE A 547
LEU A 562
 None
 1.15A 4uymB-2nq5A:
undetectable		 4uymB-2nq5A:
20.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2v6b L-LACTATE
DEHYDROGENASE

(Deinococcus
radiodurans) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		4 ALA A 206
ILE A 228
LEU A 201
PHE A 172
 None
 1.13A 4uymB-2v6bA:
undetectable		 4uymB-2v6bA:
21.46
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.
2y0k PYROGLUTATMATE PORIN
OPDO

(Pseudomonas
aeruginosa) 		PF03573
(OprD) 		4 PHE A  17
ALA A  30
LEU A 370
PHE A  21
 None
 1.14A 4uymB-2y0kA:
undetectable		 4uymB-2y0kA:
22.34
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.
3ai7 XYLULOSE-5-PHOSPHATE
/FRUCTOSE-6-PHOSPHAT
E PHOSPHOKETOLASE

(Bifidobacterium
longum) 		PF03894
(XFP)
PF09363
(XFP_C)
PF09364
(XFP_N) 		4 TYR A 291
TYR A 242
ALA A 178
ILE A 168
 None
 0.73A 4uymB-3ai7A:
0.6		 4uymB-3ai7A:
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.
3bhw UNCHARACTERIZED
PROTEIN

(Magnetospirillum
magneticum) 		PF08849
(DUF1819) 		4 TYR A 161
ALA A  92
ILE A 195
LEU A 103
 None
 1.02A 4uymB-3bhwA:
undetectable		 4uymB-3bhwA:
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.
3bt7 TRNA
(URACIL-5-)-METHYLTR
ANSFERASE

(Escherichia
coli) 		PF05958
(tRNA_U5-meth_tr) 		4 TYR A 291
ALA A 273
ILE A 263
PHE A 270
 None
 1.10A 4uymB-3bt7A:
undetectable		 4uymB-3bt7A:
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.
3byw PUTATIVE
ARABINOFURANOSYLTRAN
SFERASE

(Corynebacterium
diphtheriae) 		PF04602
(Arabinose_trans) 		4 ALA A 188
ILE A 166
LEU A 100
PHE A  65
 None
 1.07A 4uymB-3bywA:
undetectable		 4uymB-3bywA:
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.
3cia COLD-ACTIVE
AMINOPEPTIDASE

(Colwellia
psychrerythraea) 		PF01433
(Peptidase_M1)
PF09127
(Leuk-A4-hydro_C) 		4 PHE A 429
ILE A 475
LEU A 454
PHE A 450
 None
 0.78A 4uymB-3ciaA:
undetectable		 4uymB-3ciaA:
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.
3fef PUTATIVE GLUCOSIDASE
LPLD,
ALPHA-GALACTURONIDAS
E

(Bacillus
subtilis) 		PF02056
(Glyco_hydro_4)
PF11975
(Glyco_hydro_4C) 		4 TYR A 149
ALA A  13
ILE A 336
LEU A  26
 None
 1.08A 4uymB-3fefA:
undetectable		 4uymB-3fefA:
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.
3hl4 CHOLINE-PHOSPHATE
CYTIDYLYLTRANSFERASE
A

(Rattus
norvegicus) 		PF01467
(CTP_transf_like) 		4 TYR A 173
TYR A 182
ALA A 149
ILE A  84
 CDC  A 237 (-3.7A)
None
None
CDC  A 237 (-4.2A)
 0.78A 4uymB-3hl4A:
undetectable		 4uymB-3hl4A:
19.53
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.
3hzj RAB
GTPASE-ACTIVATING
PROTEIN 1-LIKE

(Homo sapiens) 		PF00566
(RabGAP-TBC) 		4 PHE A 700
ALA A 732
ILE A 779
LEU A 673
 None
 0.98A 4uymB-3hzjA:
undetectable		 4uymB-3hzjA:
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.
3ix1 N-FORMYL-4-AMINO-5-A
MINOMETHYL-2-METHYLP
YRIMIDINE BINDING
PROTEIN

(Bacillus
halodurans) 		PF09084
(NMT1) 		4 PHE A  57
ALA A 242
ILE A 328
LEU A  86
 None
 1.10A 4uymB-3ix1A:
undetectable		 4uymB-3ix1A:
21.78
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.
3k0b PREDICTED
N6-ADENINE-SPECIFIC
DNA METHYLASE

(Listeria
monocytogenes) 		PF01170
(UPF0020)
PF02926
(THUMP) 		4 TYR A 195
ALA A 289
ILE A 260
LEU A 319
 None
 1.00A 4uymB-3k0bA:
undetectable		 4uymB-3k0bA:
22.31
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.
3k40 AROMATIC-L-AMINO-ACI
D DECARBOXYLASE

(Drosophila
melanogaster) 		PF00282
(Pyridoxal_deC) 		4 ALA A 110
ILE A  98
LEU A 357
PHE A 354
 None
 0.66A 4uymB-3k40A:
undetectable		 4uymB-3k40A:
20.92
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.
3pmc UNCHARACTERIZED
PROTEIN
PXO2-61/BXB0075/GBAA
_PXO2_0075

(Bacillus
anthracis) 		PF09385
(HisK_N) 		4 PHE A 120
ALA A  91
LEU A  12
PHE A  19
 None
 1.01A 4uymB-3pmcA:
1.2		 4uymB-3pmcA:
16.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3psg PEPSINOGEN

(Sus scrofa) 		PF00026
(Asp)
PF07966
(A1_Propeptide) 		4 TYR A 309
ALA A 273
ILE A 258
LEU A 221
 None
 0.79A 4uymB-3psgA:
undetectable		 4uymB-3psgA:
22.84
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.
3q6d PROLINE DIPEPTIDASE

(Bacillus
anthracis) 		PF00557
(Peptidase_M24)
PF01321
(Creatinase_N) 		4 ALA A 146
ILE A 183
LEU A 211
PHE A 213
 None
 1.14A 4uymB-3q6dA:
undetectable		 4uymB-3q6dA:
23.12
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.
3qi3 HIGH AFFINITY
CGMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE 9A

(Homo sapiens) 		PF00233
(PDEase_I) 		4 TYR A 219
ALA A 288
ILE A 352
LEU A 333
 None
 1.13A 4uymB-3qi3A:
undetectable		 4uymB-3qi3A:
21.59
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.
3qkx UNCHARACTERIZED
HTH-TYPE
TRANSCRIPTIONAL
REGULATOR HI_0893

(Haemophilus
influenzae) 		PF00440
(TetR_N) 		4 ALA A   9
ILE A  44
LEU A  54
PHE A  48
 None
 1.00A 4uymB-3qkxA:
undetectable		 4uymB-3qkxA:
14.95
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.
3qtn UNCHARACTERIZED
PROTEIN C4B3.07

(Schizosaccharomyces
pombe) 		PF12753
(Nro1) 		4 ALA B  99
ILE B  66
LEU B 112
PHE B 116
 None
 1.13A 4uymB-3qtnB:
0.9		 4uymB-3qtnB:
22.93
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.
3rhg PUTATIVE
PHOPHOTRIESTERASE

(Proteus
mirabilis) 		PF02126
(PTE) 		4 TYR A 239
ALA A 276
LEU A 250
PHE A 252
 None
 0.88A 4uymB-3rhgA:
undetectable		 4uymB-3rhgA:
20.40
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.
4ayi LIPOPROTEIN GNA1870
CCOMPND 7

(Neisseria
meningitidis) 		PF08794
(Lipoprot_C) 		4 ALA D  84
ILE D 163
LEU D 113
PHE D 141
 None
 1.06A 4uymB-4ayiD:
undetectable		 4uymB-4ayiD:
21.80
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.
4azv WBDD

(Escherichia
coli) 		PF00069
(Pkinase)
PF13847
(Methyltransf_31) 		4 ALA A 291
ILE A 373
LEU A 367
PHE A 370
 None
 1.11A 4uymB-4azvA:
undetectable		 4uymB-4azvA:
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.
4azw WBDD

(Escherichia
coli) 		PF00069
(Pkinase)
PF13847
(Methyltransf_31) 		4 ALA A 291
ILE A 373
LEU A 367
PHE A 370
 None
 1.11A 4uymB-4azwA:
undetectable		 4uymB-4azwA:
21.47
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.
4beq ALANINE RACEMASE 2

(Vibrio cholerae) 		PF00842
(Ala_racemase_C)
PF01168
(Ala_racemase_N) 		4 ALA A  77
ILE A 278
LEU A 265
PHE A 266
 None
 1.12A 4uymB-4beqA:
undetectable		 4uymB-4beqA:
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.
4bop OTU
DOMAIN-CONTAINING
PROTEIN 1

(Homo sapiens) 		PF02338
(OTU) 		4 TYR A 322
ALA A 383
ILE A 392
LEU A 388
 None
 1.06A 4uymB-4bopA:
undetectable		 4uymB-4bopA:
13.62
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.
4by9 NOP5/NOP56 RELATED
PROTEIN

(Pyrococcus
furiosus) 		PF01798
(Nop) 		4 ALA C 204
ILE C 183
LEU C 160
PHE C 157
 None
 1.06A 4uymB-4by9C:
undetectable		 4uymB-4by9C:
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.
4dzi PUTATIVE TIM-BARREL
METAL-DEPENDENT
HYDROLASE

(Mycobacterium
avium) 		PF04909
(Amidohydro_2) 		4 ALA A 388
ILE A 291
LEU A 190
PHE A 118
 None
 1.03A 4uymB-4dziA:
undetectable		 4uymB-4dziA:
23.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4fiu HEMAGGLUTININ

(Influenza A
virus) 		PF00509
(Hemagglutinin) 		4 TYR A 194
TYR A 160
ALA A 251
ILE A 181
 None
 1.11A 4uymB-4fiuA:
undetectable		 4uymB-4fiuA:
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.
4h7u PYRANOSE
DEHYDROGENASE

(Leucoagaricus
meleagris) 		PF00732
(GMC_oxred_N)
PF05199
(GMC_oxred_C) 		4 PHE A 508
ALA A 424
ILE A 389
LEU A 463
 None
 1.04A 4uymB-4h7uA:
undetectable		 4uymB-4h7uA:
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.
4kps HEMAGGLUTININ

(Influenza A
virus) 		PF00509
(Hemagglutinin) 		4 TYR A 195
TYR A 161
ALA A 253
ILE A 182
 None
 1.12A 4uymB-4kpsA:
undetectable		 4uymB-4kpsA:
21.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4kvo N-TERMINAL
ACETYLTRANSFERASE A
COMPLEX SUBUNIT NAT1

(Schizosaccharomyces
pombe) 		PF12569
(NARP1) 		4 TYR A 546
PHE A 193
ALA A 153
LEU A 158
 None
 0.71A 4uymB-4kvoA:
undetectable		 4uymB-4kvoA:
20.73
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.
4l63 ECXB

(Escherichia
coli) 		PF01376
(Enterotoxin_b) 		4 ALA B  46
ILE B  40
LEU B  85
PHE B  48
 None
 1.13A 4uymB-4l63B:
undetectable		 4uymB-4l63B:
12.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ltu FERREDOXIN

(Rhodopseudomonas
palustris) 		PF00111
(Fer2) 		4 ALA A  26
ILE A  35
LEU A  99
PHE A   5
 None
 1.05A 4uymB-4ltuA:
undetectable		 4uymB-4ltuA:
12.13
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.
4n6b SERINE
ACETYLTRANSFERASE
APOENZYME

(Glycine max) 		PF00132
(Hexapep)
PF06426
(SATase_N) 		4 PHE A  82
ALA A  92
LEU A 120
PHE A 119
 None
 0.89A 4uymB-4n6bA:
undetectable		 4uymB-4n6bA:
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.
4pj6 LEUCYL-CYSTINYL
AMINOPEPTIDASE

(Homo sapiens) 		PF01433
(Peptidase_M1)
PF11838
(ERAP1_C) 		4 PHE A 294
ALA A 360
ILE A 319
LEU A 179
 None
 0.95A 4uymB-4pj6A:
undetectable		 4uymB-4pj6A:
21.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4qgr DEGT/DNRJ/ERYC1/STRS
AMINOTRANSFERASE

(Brucella
abortus) 		PF01041
(DegT_DnrJ_EryC1) 		4 PHE A  39
ALA A 201
LEU A  47
PHE A 203
 None
 1.08A 4uymB-4qgrA:
undetectable		 4uymB-4qgrA:
21.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4s38 4-HYDROXY-3-METHYLBU
T-2-EN-1-YL
DIPHOSPHATE SYNTHASE

(Thermus
thermophilus) 		PF04551
(GcpE) 		4 TYR A 397
PHE A 390
ALA A 339
LEU A 336
 None
 0.85A 4uymB-4s38A:
undetectable		 4uymB-4s38A:
24.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4tmc OLD YELLOW ENZYME

(Kluyveromyces
marxianus) 		PF00724
(Oxidored_FMN) 		4 PHE A   6
ALA A 327
ILE A 344
LEU A  11
 None
 1.11A 4uymB-4tmcA:
undetectable		 4uymB-4tmcA:
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.
4tr6 DNA POLYMERASE III
SUBUNIT BETA

(Bacillus
subtilis) 		PF00712
(DNA_pol3_beta)
PF02767
(DNA_pol3_beta_2)
PF02768
(DNA_pol3_beta_3) 		4 PHE A   5
ILE A  87
LEU A  79
PHE A  84
 None
 0.81A 4uymB-4tr6A:
undetectable		 4uymB-4tr6A:
23.58
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.
4tx8 PROBABLE CHITINASE A

(Chromobacterium
violaceum) 		PF00704
(Glyco_hydro_18) 		4 ALA A 323
ILE A 301
LEU A 350
PHE A 368
 None
 1.04A 4uymB-4tx8A:
undetectable		 4uymB-4tx8A:
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.
4u8d SORCIN

(Homo sapiens) 		PF13405
(EF-hand_6)
PF13833
(EF-hand_8) 		4 TYR A 159
PHE A  70
ALA A  64
ILE A 110
 None
 1.01A 4uymB-4u8dA:
undetectable		 4uymB-4u8dA:
18.22
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4uhi STEROL 14-ALPHA
DEMETHYLASE

(Homo sapiens) 		PF00067
(p450) 		5 TYR A 131
PHE A 139
TYR A 145
ALA A 311
ILE A 377
 VFV  A 580 (-4.1A)
VFV  A 580 (-4.2A)
HEM  A 540 (-4.5A)
HEM  A 540 ( 3.4A)
HEM  A 540 ( 3.9A)
 0.83A 4uymB-4uhiA:
47.8		 4uymB-4uhiA:
40.43
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.
4xll DJ-1 FAMILY PROTEIN

(Toxoplasma
gondii) 		PF01965
(DJ-1_PfpI) 		4 ALA A 102
ILE A  21
LEU A 164
PHE A 160
 None
 0.92A 4uymB-4xllA:
undetectable		 4uymB-4xllA:
17.66
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.
4xnq INFLUENZA H5 HA HEAD
DOMAIN VIETNAM RDT
MUTATIONS

(Influenza A
virus) 		no annotation 4 TYR D 195
TYR D 161
ALA D 132
ILE D 252
 None
 1.06A 4uymB-4xnqD:
undetectable		 4uymB-4xnqD:
19.70
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.
5a7d INSCUTEABLE

(Drosophila
melanogaster) 		no annotation 4 PHE L 468
ALA L 360
LEU L 403
PHE L 399
 None
 1.10A 4uymB-5a7dL:
1.3		 4uymB-5a7dL:
22.93
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.
5bop OCTARELLIN V.1

(synthetic
construct) 		no annotation 4 PHE B  45
ALA B 110
ILE B  99
PHE B 103
 None
 1.07A 4uymB-5bopB:
undetectable		 4uymB-5bopB:
18.20
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.
5cbm M17 FAMILY
AMINOPEPTIDASE

(Plasmodium
falciparum) 		PF00883
(Peptidase_M17) 		4 PHE A 354
ALA A 469
ILE A 481
LEU A 476
 None
 1.11A 4uymB-5cbmA:
undetectable		 4uymB-5cbmA:
23.62
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.
5ewq AMIDASE

(Bacillus
anthracis) 		PF01425
(Amidase) 		4 TYR A  94
ALA A 122
ILE A 140
PHE A 184
 None
 0.99A 4uymB-5ewqA:
undetectable		 4uymB-5ewqA:
21.82
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.
5exr DNA POLYMERASE ALPHA
SUBUNIT B

(Homo sapiens) 		PF04042
(DNA_pol_E_B)
PF08418
(Pol_alpha_B_N) 		4 PHE D 525
TYR D 435
ILE D 502
LEU D 531
 None
 1.08A 4uymB-5exrD:
undetectable		 4uymB-5exrD:
20.74
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.
5fok IRON TRANSPORT OUTER
MEMBRANE RECEPTOR

(Pseudomonas
aeruginosa) 		PF00593
(TonB_dep_Rec)
PF07715
(Plug) 		4 PHE A  80
ALA A  69
ILE A  55
LEU A 145
 None
 1.03A 4uymB-5fokA:
undetectable		 4uymB-5fokA:
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.
5gy0 GLUCANASE

(Ruminiclostridium
thermocellum) 		PF00759
(Glyco_hydro_9)
PF00942
(CBM_3) 		4 ALA A  36
ILE A 362
LEU A 414
PHE A 444
 None
 1.11A 4uymB-5gy0A:
undetectable		 4uymB-5gy0A:
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.
5h67 CHROMOSOME PARTITION
PROTEIN SMC

(Bacillus
subtilis) 		PF02463
(SMC_N) 		4 PHE B1052
ALA B1100
ILE A 149
LEU B1086
 None
 1.11A 4uymB-5h67B:
undetectable		 4uymB-5h67B:
17.41
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.
5huu ALPHA,ALPHA-TREHALOS
E-PHOSPHATE SYNTHASE
[UDP-FORMING]

(Candida
albicans) 		PF00982
(Glyco_transf_20) 		4 TYR A 180
ILE A 199
LEU A 170
PHE A 168
 None
 1.14A 4uymB-5huuA:
undetectable		 4uymB-5huuA:
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.
5hxb EUKARYOTIC PEPTIDE
CHAIN RELEASE FACTOR
GTP-BINDING SUBUNIT
ERF3A

(Homo sapiens) 		no annotation 4 TYR X 548
ALA X 593
ILE X 537
LEU X 617
 None
 1.07A 4uymB-5hxbX:
undetectable		 4uymB-5hxbX:
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.
5jou ALPHA-XYLOSIDASE
BOGH31A

(Bacteroides
ovatus) 		PF01055
(Glyco_hydro_31)
PF16338
(DUF4968)
PF17137
(DUF5110) 		4 TYR A 415
ALA A 708
LEU A 435
PHE A 408
 None
 1.07A 4uymB-5jouA:
undetectable		 4uymB-5jouA:
18.95
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.
5kh0 SMALL GTP-BINDING
PROTEIN

(Thermosipho
melanesiensis) 		PF01926
(MMR_HSR1) 		4 ALA A 120
ILE A  13
LEU A  28
PHE A  24
 None
 0.81A 4uymB-5kh0A:
undetectable		 4uymB-5kh0A:
21.14
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.
5mc9 LAMININ SUBUNIT
ALPHA-1

(Mus musculus) 		PF00054
(Laminin_G_1)
PF06009
(Laminin_II) 		4 PHE A2318
ALA A2324
ILE A2442
LEU A2469
 None
 1.07A 4uymB-5mc9A:
undetectable		 4uymB-5mc9A:
22.43
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.
5mnd GRANULIN

(Cydia pomonella
granulovirus) 		PF00738
(Polyhedrin) 		4 TYR A 150
ALA A 143
ILE A 156
LEU A  88
 None
 0.95A 4uymB-5mndA:
undetectable		 4uymB-5mndA:
19.87
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.
5nl0 HISTONE H1.0-B

(Xenopus laevis) 		PF00538
(Linker_histone) 		4 ALA Z  89
ILE Z  50
LEU Z  81
PHE Z  93
 None
 0.89A 4uymB-5nl0Z:
undetectable		 4uymB-5nl0Z:
17.95
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.
5pep PEPSIN

(Sus scrofa) 		PF00026
(Asp) 		4 TYR A 310
ALA A 274
ILE A 259
LEU A 221
 None
 0.67A 4uymB-5pepA:
undetectable		 4uymB-5pepA:
22.90
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.
5tfq BETA-LACTAMASE

(Bacteroides
cellulosilyticus) 		PF13354
(Beta-lactamase2) 		4 PHE A  52
ALA A 174
LEU A  59
PHE A 180
 None
 0.81A 4uymB-5tfqA:
undetectable		 4uymB-5tfqA:
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.
5u0l N-SUCCINYLGLUTAMATE
5-SEMIALDEHYDE
DEHYDROGENASE

(Marinobacter
hydrocarbonoclasticus) 		PF00171
(Aldedh) 		4 PHE A 146
ALA A 213
LEU A 245
PHE A 237
 EDO  A 508 ( 4.0A)
EDO  A 508 ( 4.8A)
None
None
 1.10A 4uymB-5u0lA:
undetectable		 4uymB-5u0lA:
22.02
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.
5u7x NOD FACTOR BINDING
LECTIN-NUCLEOTIDE
PHOSPHOHYDROLASE

(Vigna
unguiculata) 		PF01150
(GDA1_CD39) 		4 ALA F   8
ILE F 399
LEU F  31
PHE F  25
 None
 1.07A 4uymB-5u7xF:
undetectable		 4uymB-5u7xF:
21.40
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.
5vfa RESPONSE REGULATOR

(Streptococcus
pneumoniae) 		no annotation 4 ALA A  38
ILE A  77
LEU A  68
PHE A  64
 None
 1.12A 4uymB-5vfaA:
undetectable		 4uymB-5vfaA:
9.25
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.
6a0z HEMAGGLUTININ,ENVELO
PE GLYCOPROTEIN

(Human
immunodeficiency
virus 1;
Influenza A
virus) 		no annotation 4 TYR A 195
TYR A 161
ALA A 132
ILE A 252
 None
 1.07A 4uymB-6a0zA:
undetectable		 4uymB-6a0zA:
9.40
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6ay4 CYP51, STEROL
14ALPHA-DEMETHYLASE

(Naegleria
fowleri) 		no annotation 4 TYR A 107
PHE A 114
TYR A 120
LEU A 467
 TPF  A 506 (-4.2A)
TPF  A 506 (-4.4A)
None
EDO  A 503 (-4.2A)
 0.72A 4uymB-6ay4A:
44.1		 4uymB-6ay4A:
35.33
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.
6az1 RIBOSOMAL PROTEIN
S25E

(Leishmania
donovani) 		no annotation 4 PHE a  42
ALA a  76
ILE a  60
LEU a  83
 None
 0.74A 4uymB-6az1a:
undetectable		 4uymB-6az1a:
12.41
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.
6c2h CYSTATHIONINE
BETA-SYNTHASE

(Saccharomyces
cerevisiae) 		no annotation 4 TYR A 274
PHE A 317
ILE A  35
LEU A  29
 None
 0.83A 4uymB-6c2hA:
undetectable		 4uymB-6c2hA:
11.34
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.
6fcx METHYLENETETRAHYDROF
OLATE REDUCTASE

(Homo sapiens) 		no annotation 4 PHE A 207
ALA A 242
ILE A 252
LEU A 214
 None
 0.97A 4uymB-6fcxA:
undetectable		 4uymB-6fcxA:
10.96
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.
6gy8 -

(-) 		no annotation 4 ALA A  98
ILE A  51
LEU A 202
PHE A 198
 None
 0.99A 4uymB-6gy8A:
undetectable		 4uymB-6gy8A:
undetectable