SIMILAR PATTERNS OF AMINO ACIDS FOR 1KQE_E_DVAE6

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.
1amk TRIOSE PHOSPHATE
ISOMERASE

(Leishmania
mexicana) 		PF00121
(TIM) 		3 TRP A  12
ALA A  64
VAL A  41
 None
 0.80A 1kqeA-1amkA:
undetectable
1kqeE-1amkA:
undetectable		 1kqeA-1amkA:
11.43
1kqeE-1amkA:
11.43
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.
1bci CYTOSOLIC
PHOSPHOLIPASE A2

(Homo sapiens) 		PF00168
(C2) 		3 TRP A  71
ALA A  94
VAL A  46
 None
 0.88A 1kqeA-1bciA:
undetectable
1kqeE-1bciA:
undetectable		 1kqeA-1bciA:
4.35
1kqeE-1bciA:
4.35
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.
1e8c UDP-N-ACETYLMURAMOYL
ALANYL-D-GLUTAMATE--
2,6-DIAMINOPIMELATE
LIGASE

(Escherichia
coli) 		PF01225
(Mur_ligase)
PF02875
(Mur_ligase_C)
PF08245
(Mur_ligase_M) 		3 TRP A 248
ALA A 240
VAL A 244
 None
 0.89A 1kqeA-1e8cA:
undetectable
1kqeE-1e8cA:
undetectable		 1kqeA-1e8cA:
3.74
1kqeE-1e8cA:
3.74
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.
1ego GLUTAREDOXIN

(Escherichia
coli) 		PF00462
(Glutaredoxin) 		3 TRP A  78
ALA A  85
VAL A  79
 None
 0.87A 1kqeA-1egoA:
undetectable
1kqeE-1egoA:
undetectable		 1kqeA-1egoA:
3.53
1kqeE-1egoA:
3.53
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.
1fhu O-SUCCINYLBENZOATE
SYNTHASE

(Escherichia
coli) 		PF13378
(MR_MLE_C) 		3 TRP A  66
ALA A  72
VAL A  67
 None
 0.82A 1kqeA-1fhuA:
undetectable
1kqeE-1fhuA:
undetectable		 1kqeA-1fhuA:
5.42
1kqeE-1fhuA:
5.42
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.
1hju BETA-1,4-GALACTANASE

(Thermothelomyces
thermophila) 		PF07745
(Glyco_hydro_53) 		3 TRP A 191
ALA A 151
VAL A 195
 None
 0.86A 1kqeA-1hjuA:
undetectable
1kqeE-1hjuA:
undetectable		 1kqeA-1hjuA:
5.38
1kqeE-1hjuA:
5.38
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.
1iom CITRATE SYNTHASE

(Thermus
thermophilus) 		PF00285
(Citrate_synt) 		3 TRP A 242
ALA A 248
VAL A 243
 None
 0.78A 1kqeA-1iomA:
undetectable
1kqeE-1iomA:
undetectable		 1kqeA-1iomA:
2.50
1kqeE-1iomA:
2.50
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.
1jtd BETA-LACTAMASE
INHIBITOR PROTEIN II

(Streptomyces
exfoliatus) 		PF13540
(RCC1_2) 		3 TRP B  87
ALA B  60
VAL B  58
 None
 0.79A 1kqeA-1jtdB:
undetectable
1kqeE-1jtdB:
undetectable		 1kqeA-1jtdB:
2.94
1kqeE-1jtdB:
2.94
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.
1jtd BETA-LACTAMASE
INHIBITOR PROTEIN II

(Streptomyces
exfoliatus) 		PF13540
(RCC1_2) 		3 TRP B 204
ALA B 177
VAL B 175
 None
 0.88A 1kqeA-1jtdB:
undetectable
1kqeE-1jtdB:
undetectable		 1kqeA-1jtdB:
2.94
1kqeE-1jtdB:
2.94
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.
1jtd BETA-LACTAMASE
INHIBITOR PROTEIN II

(Streptomyces
exfoliatus) 		PF13540
(RCC1_2) 		3 TRP B 243
ALA B 216
VAL B 214
 None
 0.81A 1kqeA-1jtdB:
undetectable
1kqeE-1jtdB:
undetectable		 1kqeA-1jtdB:
2.94
1kqeE-1jtdB:
2.94
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.
1le8 MATING-TYPE PROTEIN
ALPHA-2

(Saccharomyces
cerevisiae) 		PF00046
(Homeobox) 		3 TRP B 179
ALA B 185
VAL B 180
 None
 0.75A 1kqeA-1le8B:
undetectable
1kqeE-1le8B:
undetectable		 1kqeA-1le8B:
9.43
1kqeE-1le8B:
9.43
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.
1m6j TRIOSEPHOSPHATE
ISOMERASE

(Entamoeba
histolytica) 		PF00121
(TIM) 		3 TRP A  12
ALA A  71
VAL A  44
 None
 0.87A 1kqeA-1m6jA:
undetectable
1kqeE-1m6jA:
undetectable		 1kqeA-1m6jA:
5.11
1kqeE-1m6jA:
5.11
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.
1ofc ISWI PROTEIN

(Drosophila
melanogaster) 		PF09110
(HAND)
PF09111
(SLIDE) 		3 TRP X 800
ALA X 840
VAL X 835
 None
 0.86A 1kqeA-1ofcX:
undetectable
1kqeE-1ofcX:
undetectable		 1kqeA-1ofcX:
3.24
1kqeE-1ofcX:
3.24
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.
1oqa BREAST CANCER TYPE 1
SUSCEPTIBILITY
PROTEIN

(Homo sapiens) 		PF00533
(BRCT) 		3 TRP A  84
ALA A  90
VAL A  85
 None
 0.81A 1kqeA-1oqaA:
undetectable
1kqeE-1oqaA:
undetectable		 1kqeA-1oqaA:
10.29
1kqeE-1oqaA:
10.29
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.
1osg TUMOR NECROSIS
FACTOR LIGAND
SUPERFAMILY MEMBER
13B

(Homo sapiens) 		PF00229
(TNF) 		3 TRP A 168
ALA A 262
VAL A 166
 None
 0.89A 1kqeA-1osgA:
undetectable
1kqeE-1osgA:
undetectable		 1kqeA-1osgA:
3.91
1kqeE-1osgA:
3.91
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.
1tcd TRIOSEPHOSPHATE
ISOMERASE

(Trypanosoma
cruzi) 		PF00121
(TIM) 		3 TRP A  13
ALA A  65
VAL A  42
 None
 0.84A 1kqeA-1tcdA:
undetectable
1kqeE-1tcdA:
undetectable		 1kqeA-1tcdA:
7.27
1kqeE-1tcdA:
7.27
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.
1u2q LOW MOLECULAR WEIGHT
PROTEIN-TYROSINE-PHO
SPHATASE

(Mycobacterium
tuberculosis) 		PF01451
(LMWPc) 		3 TRP A 152
ALA A 158
VAL A 153
 None
 0.75A 1kqeA-1u2qA:
undetectable
1kqeE-1u2qA:
undetectable		 1kqeA-1u2qA:
5.98
1kqeE-1u2qA:
5.98
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.
1w36 EXODEOXYRIBONUCLEASE
V GAMMA CHAIN

(Escherichia
coli) 		PF04257
(Exonuc_V_gamma) 		3 TRP C1006
ALA C 842
VAL C 974
 None
 0.87A 1kqeA-1w36C:
undetectable
1kqeE-1w36C:
undetectable		 1kqeA-1w36C:
1.67
1kqeE-1w36C:
1.67
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.
1x1n 4-ALPHA-GLUCANOTRANS
FERASE

(Solanum
tuberosum) 		PF02446
(Glyco_hydro_77) 		3 TRP A 286
ALA A 331
VAL A 274
 GOL  A1002 (-3.4A)
None
None
 0.76A 1kqeA-1x1nA:
undetectable
1kqeE-1x1nA:
undetectable		 1kqeA-1x1nA:
5.41
1kqeE-1x1nA:
5.41
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.
1xc6 BETA-GALACTOSIDASE

(Penicillium sp.) 		PF01301
(Glyco_hydro_35)
PF10435
(BetaGal_dom2)
PF13363
(BetaGal_dom3)
PF13364
(BetaGal_dom4_5) 		3 TRP A 549
ALA A 554
VAL A 551
 None
 0.76A 1kqeA-1xc6A:
undetectable
1kqeE-1xc6A:
undetectable		 1kqeA-1xc6A:
1.25
1kqeE-1xc6A:
1.25
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.
1yr2 PROLYL
OLIGOPEPTIDASE

(Novosphingobium
capsulatum) 		PF00326
(Peptidase_S9)
PF02897
(Peptidase_S9_N) 		3 TRP A  77
ALA A  83
VAL A  78
 None
 0.80A 1kqeA-1yr2A:
undetectable
1kqeE-1yr2A:
undetectable		 1kqeA-1yr2A:
3.08
1kqeE-1yr2A:
3.08
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.
1zun SULFATE ADENYLATE
TRANSFERASE, SUBUNIT
1/ADENYLYLSULFATE
KINASE

(Pseudomonas
syringae group
genomosp. 3) 		PF00009
(GTP_EFTU) 		3 TRP B 341
ALA B 429
VAL B 427
 None
 0.77A 1kqeA-1zunB:
undetectable
1kqeE-1zunB:
undetectable		 1kqeA-1zunB:
2.12
1kqeE-1zunB:
2.12
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.
2b24 NAPHTHALENE
DIOXYGENASE SMALL
SUBUNIT

(Rhodococcus sp.
NCIMB 12038) 		PF00866
(Ring_hydroxyl_B) 		3 TRP B 541
ALA B 659
VAL B 545
 None
 0.84A 1kqeA-2b24B:
undetectable
1kqeE-2b24B:
undetectable		 1kqeA-2b24B:
5.98
1kqeE-2b24B:
5.98
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.
2btm PROTEIN
(TRIOSEPHOSPHATE
ISOMERASE)

(Geobacillus
stearothermophilus) 		PF00121
(TIM) 		3 TRP A   9
ALA A  62
VAL A  39
 None
 0.82A 1kqeA-2btmA:
undetectable
1kqeE-2btmA:
undetectable		 1kqeA-2btmA:
7.41
1kqeE-2btmA:
7.41
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.
2e4u METABOTROPIC
GLUTAMATE RECEPTOR 3

(Rattus
norvegicus) 		PF01094
(ANF_receptor)
PF07562
(NCD3G) 		3 TRP A 303
ALA A 286
VAL A 310
 None
 0.85A 1kqeA-2e4uA:
undetectable
1kqeE-2e4uA:
undetectable		 1kqeA-2e4uA:
9.64
1kqeE-2e4uA:
9.64
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.
2h2t LOW AFFINITY
IMMUNOGLOBULIN
EPSILON FC RECEPTOR
(LYMPHOCYTE IGE
RECEPTOR)
(FC-EPSILON-RII)
(IMMUNOGLOBULIN
E-BINDING FACTOR)
(CD23 ANTIGEN)

(Homo sapiens) 		PF00059
(Lectin_C) 		3 TRP B 184
ALA B 190
VAL B 185
 None
 0.86A 1kqeA-2h2tB:
undetectable
1kqeE-2h2tB:
undetectable		 1kqeA-2h2tB:
4.57
1kqeE-2h2tB:
4.57
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.
2imj HYPOTHETICAL PROTEIN
DUF1348

(Pseudomonas
protegens) 		PF07080
(DUF1348) 		3 TRP A 113
ALA A  83
VAL A  91
 None
 0.59A 1kqeA-2imjA:
undetectable
1kqeE-2imjA:
undetectable		 1kqeA-2imjA:
11.39
1kqeE-2imjA:
11.39
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.
2jxy MACROPHAGE
METALLOELASTASE

(Homo sapiens) 		PF00045
(Hemopexin) 		3 TRP A 401
ALA A 382
VAL A 396
 None
CA  A 471 ( 4.3A)
None
 0.73A 1kqeA-2jxyA:
undetectable
1kqeE-2jxyA:
undetectable		 1kqeA-2jxyA:
4.42
1kqeE-2jxyA:
4.42
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.
2kwb TRANSLATIONALLY-CONT
ROLLED TUMOR PROTEIN
HOMOLOG

(Caenorhabditis
elegans) 		PF00838
(TCTP) 		3 TRP A 123
ALA A 129
VAL A 124
 None
 0.84A 1kqeA-2kwbA:
undetectable
1kqeE-2kwbA:
undetectable		 1kqeA-2kwbA:
6.67
1kqeE-2kwbA:
6.67
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.
2ms7 MITOCHONDRIAL
ANTIVIRAL-SIGNALING
PROTEIN

(Homo sapiens) 		PF16739
(CARD_2) 		3 TRP A  68
ALA A  74
VAL A  69
 None
 0.83A 1kqeA-2ms7A:
undetectable
1kqeE-2ms7A:
undetectable		 1kqeA-2ms7A:
12.12
1kqeE-2ms7A:
12.12
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.
2nog ISWI PROTEIN

(Xenopus laevis) 		PF09110
(HAND) 		3 TRP A 829
ALA A 869
VAL A 864
 None
 0.86A 1kqeA-2nogA:
undetectable
1kqeE-2nogA:
undetectable		 1kqeA-2nogA:
6.38
1kqeE-2nogA:
6.38
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.
2pm9 PROTEIN TRANSPORT
PROTEIN SEC31

(Saccharomyces
cerevisiae) 		PF00400
(WD40) 		3 TRP A 217
ALA A 173
VAL A 175
 None
 0.77A 1kqeA-2pm9A:
undetectable
1kqeE-2pm9A:
undetectable		 1kqeA-2pm9A:
3.10
1kqeE-2pm9A:
3.10
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.
2wds HOLO-[ACYL-CARRIER-P
ROTEIN] SYNTHASE

(Streptomyces
coelicolor) 		PF01648
(ACPS) 		3 TRP A 104
ALA A  97
VAL A 101
 None
 0.87A 1kqeA-2wdsA:
undetectable
1kqeE-2wdsA:
undetectable		 1kqeA-2wdsA:
9.68
1kqeE-2wdsA:
9.68
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.
2yjp PUTATIVE ABC
TRANSPORTER,
PERIPLASMIC BINDING
PROTEIN, AMINO ACID

(Neisseria
gonorrhoeae) 		PF00497
(SBP_bac_3) 		3 TRP A 246
ALA A 252
VAL A 247
 None
 0.82A 1kqeA-2yjpA:
undetectable
1kqeE-2yjpA:
undetectable		 1kqeA-2yjpA:
5.06
1kqeE-2yjpA:
5.06
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.
2yka RNA AND EXPORT
FACTOR-BINDING
PROTEIN 2
52 KDA
IMMEDIATE-EARLY
PHOSPHOPROTEIN

(Mus musculus;
Saimiriine
gammaherpesvirus
2) 		PF00076
(RRM_1)
no annotation 		3 TRP B 108
ALA A  89
VAL A  86
 None
 0.78A 1kqeA-2ykaB:
undetectable
1kqeE-2ykaB:
undetectable		 1kqeA-2ykaB:
16.67
1kqeE-2ykaB:
16.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ylz PHENYLACETONE
MONOOXYGENASE

(Thermobifida
fusca) 		PF13738
(Pyr_redox_3) 		3 TRP A 456
ALA A 462
VAL A 457
 None
 0.80A 1kqeA-2ylzA:
undetectable
1kqeE-2ylzA:
undetectable		 1kqeA-2ylzA:
10.47
1kqeE-2ylzA:
10.47
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.
2ziu CROSSOVER JUNCTION
ENDONUCLEASE EME1

(Homo sapiens) 		PF02732
(ERCC4) 		3 TRP B 429
ALA B 318
VAL B 364
 None
 0.83A 1kqeA-2ziuB:
undetectable
1kqeE-2ziuB:
undetectable		 1kqeA-2ziuB:
2.46
1kqeE-2ziuB:
2.46
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.
3aib GLUCOSYLTRANSFERASE-
SI

(Streptococcus
mutans) 		PF02324
(Glyco_hydro_70) 		3 TRP A 956
ALA A 478
VAL A 476
 None
 0.68A 1kqeA-3aibA:
undetectable
1kqeE-3aibA:
undetectable		 1kqeA-3aibA:
1.74
1kqeE-3aibA:
1.74
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.
3bqw PUTATIVE CAPSID
PROTEIN OF PROPHAGE

(Escherichia
coli) 		PF03864
(Phage_cap_E) 		3 TRP A 163
ALA A 340
VAL A 338
 None
 0.84A 1kqeA-3bqwA:
undetectable
1kqeE-3bqwA:
undetectable		 1kqeA-3bqwA:
4.30
1kqeE-3bqwA:
4.30
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.
3d1j GLYCOGEN SYNTHASE

(Escherichia
coli) 		PF00534
(Glycos_transf_1)
PF08323
(Glyco_transf_5) 		3 TRP A 115
ALA A 121
VAL A 116
 None
 0.76A 1kqeA-3d1jA:
undetectable
1kqeE-3d1jA:
undetectable		 1kqeA-3d1jA:
6.49
1kqeE-3d1jA:
6.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3e7q TRANSCRIPTIONAL
REGULATOR

(Pseudomonas
aeruginosa) 		PF00440
(TetR_N)
PF13977
(TetR_C_6) 		3 TRP A 196
ALA A 202
VAL A 197
 None
 0.75A 1kqeA-3e7qA:
undetectable
1kqeE-3e7qA:
undetectable		 1kqeA-3e7qA:
5.52
1kqeE-3e7qA:
5.52
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.
3ee4 PROBABLE
RIBONUCLEOSIDE-DIPHO
SPHATE REDUCTASE

(Mycobacterium
tuberculosis) 		PF00268
(Ribonuc_red_sm) 		3 TRP A 111
ALA A  44
VAL A 115
 None
 0.84A 1kqeA-3ee4A:
undetectable
1kqeE-3ee4A:
undetectable		 1kqeA-3ee4A:
4.60
1kqeE-3ee4A:
4.60
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.
3fbs OXIDOREDUCTASE

(Agrobacterium
fabrum) 		PF07992
(Pyr_redox_2) 		3 TRP A 230
ALA A  33
VAL A  79
 None
FAD  A 298 (-3.5A)
FAD  A 298 (-4.0A)
 0.86A 1kqeA-3fbsA:
undetectable
1kqeE-3fbsA:
undetectable		 1kqeA-3fbsA:
10.34
1kqeE-3fbsA:
10.34
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.
3gg2 SUGAR DEHYDROGENASE,
UDP-GLUCOSE/GDP-MANN
OSE DEHYDROGENASE
FAMILY

(Porphyromonas
gingivalis) 		PF00984
(UDPG_MGDP_dh)
PF03720
(UDPG_MGDP_dh_C)
PF03721
(UDPG_MGDP_dh_N) 		3 TRP A 400
ALA A 464
VAL A 459
 None
 0.87A 1kqeA-3gg2A:
undetectable
1kqeE-3gg2A:
undetectable		 1kqeA-3gg2A:
2.30
1kqeE-3gg2A:
2.30
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.
3gq2 GENERAL VESICULAR
TRANSPORT FACTOR
P115

(Bos taurus) 		PF04869
(Uso1_p115_head) 		3 TRP A 272
ALA A 327
VAL A 325
 None
 0.58A 1kqeA-3gq2A:
undetectable
1kqeE-3gq2A:
undetectable		 1kqeA-3gq2A:
2.26
1kqeE-3gq2A:
2.26
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.
3hxl UNCHARACTERIZED
PROTEIN DSY3957

(Desulfitobacterium
hafniense) 		PF04984
(Phage_sheath_1)
PF17481
(Phage_sheath_1N)
PF17482
(Phage_sheath_1C) 		3 TRP A 269
ALA A 275
VAL A 270
 None
 0.84A 1kqeA-3hxlA:
undetectable
1kqeE-3hxlA:
undetectable		 1kqeA-3hxlA:
9.52
1kqeE-3hxlA:
9.52
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.
3i4i 1,3-1,4-BETA-GLUCANA
SE

(uncultured
murine large
bowel bacterium
BAC 14) 		PF00722
(Glyco_hydro_16) 		3 TRP A 194
ALA A 197
VAL A 191
 None
 0.84A 1kqeA-3i4iA:
undetectable
1kqeE-3i4iA:
undetectable		 1kqeA-3i4iA:
3.98
1kqeE-3i4iA:
3.98
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.
3if9 GLYCINE OXIDASE

(Bacillus
subtilis) 		PF01266
(DAO) 		3 TRP A 205
ALA A 325
VAL A 204
 None
 0.88A 1kqeA-3if9A:
undetectable
1kqeE-3if9A:
undetectable		 1kqeA-3if9A:
2.56
1kqeE-3if9A:
2.56
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.
3lml LIN1278 PROTEIN

(Listeria
innocua) 		PF04984
(Phage_sheath_1)
PF17481
(Phage_sheath_1N)
PF17482
(Phage_sheath_1C) 		3 TRP A 275
ALA A 281
VAL A 276
 None
 0.78A 1kqeA-3lmlA:
undetectable
1kqeE-3lmlA:
undetectable		 1kqeA-3lmlA:
2.90
1kqeE-3lmlA:
2.90
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.
3mfn UNCHARACTERIZED
PROTEIN

(Dyadobacter
fermentans) 		no annotation 3 TRP A 126
ALA A 132
VAL A 127
 None
 0.88A 1kqeA-3mfnA:
undetectable
1kqeE-3mfnA:
undetectable		 1kqeA-3mfnA:
5.65
1kqeE-3mfnA:
5.65
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.
3muo PROLYL ENDOPEPTIDASE

(Aeromonas
caviae) 		PF00326
(Peptidase_S9)
PF02897
(Peptidase_S9_N) 		3 TRP A  44
ALA A  50
VAL A  45
 None
 0.86A 1kqeA-3muoA:
undetectable
1kqeE-3muoA:
undetectable		 1kqeA-3muoA:
2.11
1kqeE-3muoA:
2.11
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.
3mz1 PUTATIVE
TRANSCRIPTIONAL
REGULATOR

(Sinorhizobium
meliloti) 		PF03466
(LysR_substrate) 		3 TRP A 284
ALA A 290
VAL A 285
 None
 0.81A 1kqeA-3mz1A:
undetectable
1kqeE-3mz1A:
undetectable		 1kqeA-3mz1A:
2.14
1kqeE-3mz1A:
2.14
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.
3nqp SUSD SUPERFAMILY
PROTEIN

(Bacteroides
fragilis) 		PF07980
(SusD_RagB)
PF14322
(SusD-like_3) 		3 TRP A 408
ALA A 414
VAL A 409
 None
 0.85A 1kqeA-3nqpA:
undetectable
1kqeE-3nqpA:
undetectable		 1kqeA-3nqpA:
2.11
1kqeE-3nqpA:
2.11
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.
3qw2 MYO-INOSITOL-1-PHOSP
HATE SYNTHASE (INO1)

(Archaeoglobus
fulgidus) 		PF01658
(Inos-1-P_synth)
PF07994
(NAD_binding_5) 		3 TRP A 387
ALA A 363
VAL A 359
 None
 0.81A 1kqeA-3qw2A:
undetectable
1kqeE-3qw2A:
undetectable		 1kqeA-3qw2A:
4.76
1kqeE-3qw2A:
4.76
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.
3r7p RIBOSOMAL PROTEIN
3/HOMING
ENDONUCLEASE-LIKE
FUSION PROTEIN

(Leptographium
truncatum) 		PF00961
(LAGLIDADG_1) 		3 TRP A 176
ALA A 182
VAL A 177
 None
 0.79A 1kqeA-3r7pA:
undetectable
1kqeE-3r7pA:
undetectable		 1kqeA-3r7pA:
4.65
1kqeE-3r7pA:
4.65
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.
3th6 TRIOSEPHOSPHATE
ISOMERASE

(Rhipicephalus
microplus) 		PF00121
(TIM) 		3 TRP A  12
ALA A  63
VAL A  41
 None
 0.87A 1kqeA-3th6A:
undetectable
1kqeE-3th6A:
undetectable		 1kqeA-3th6A:
7.02
1kqeE-3th6A:
7.02
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.
3vgl GLUCOKINASE

(Streptomyces
griseus) 		PF00480
(ROK) 		3 TRP A  83
ALA A  73
VAL A  75
 None
 0.82A 1kqeA-3vglA:
undetectable
1kqeE-3vglA:
undetectable		 1kqeA-3vglA:
3.66
1kqeE-3vglA:
3.66
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.
3vgp TRANSMEMBRANE
OLIGOSACCHARYL
TRANSFERASE,
PUTATIVE

(Archaeoglobus
fulgidus) 		no annotation 3 TRP A 471
ALA A 479
VAL A 475
 None
 0.81A 1kqeA-3vgpA:
undetectable
1kqeE-3vgpA:
undetectable		 1kqeA-3vgpA:
6.19
1kqeE-3vgpA:
6.19
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.
3wrf NON-REDUCING END
BETA-L-ARABINOFURANO
SIDASE

(Bifidobacterium
longum) 		PF07944
(Glyco_hydro_127) 		3 TRP A 469
ALA A 593
VAL A 602
 None
 0.84A 1kqeA-3wrfA:
undetectable
1kqeE-3wrfA:
undetectable		 1kqeA-3wrfA:
1.90
1kqeE-3wrfA:
1.90
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.
3zxl HIAXHD3

(Humicola
insolens) 		PF04616
(Glyco_hydro_43) 		3 TRP A 437
ALA A 468
VAL A 448
 None
 0.76A 1kqeA-3zxlA:
undetectable
1kqeE-3zxlA:
undetectable		 1kqeA-3zxlA:
2.00
1kqeE-3zxlA:
2.00
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.
4amc GLUCANSUCRASE

(Lactobacillus
reuteri) 		PF01473
(CW_binding_1)
PF02324
(Glyco_hydro_70) 		3 TRP A1510
ALA A1025
VAL A1023
 None
 0.77A 1kqeA-4amcA:
undetectable
1kqeE-4amcA:
undetectable		 1kqeA-4amcA:
3.86
1kqeE-4amcA:
3.86
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.
4ap3 STEROID
MONOOXYGENASE

(Rhodococcus
rhodochrous) 		PF00743
(FMO-like) 		3 TRP A 461
ALA A 467
VAL A 462
 None
 0.83A 1kqeA-4ap3A:
undetectable
1kqeE-4ap3A:
undetectable		 1kqeA-4ap3A:
11.11
1kqeE-4ap3A:
11.11
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.
4ayg GLUCANSUCRASE

(Lactobacillus
reuteri) 		PF01473
(CW_binding_1)
PF02324
(Glyco_hydro_70) 		3 TRP A1505
ALA A1026
VAL A1024
 None
GOL  A2791 (-3.6A)
None
 0.72A 1kqeA-4aygA:
undetectable
1kqeE-4aygA:
undetectable		 1kqeA-4aygA:
3.45
1kqeE-4aygA:
3.45
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.
4bzk PROTEIN TRANSPORT
PROTEIN SEC31

(Saccharomyces
cerevisiae) 		PF00400
(WD40)
PF12931
(Sec16_C) 		3 TRP A 217
ALA A 173
VAL A 175
 None
 0.77A 1kqeA-4bzkA:
undetectable
1kqeE-4bzkA:
undetectable		 1kqeA-4bzkA:
1.09
1kqeE-4bzkA:
1.09
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.
4gxw ADENOSINE DEAMINASE

(Burkholderia
ambifaria) 		PF00962
(A_deaminase) 		3 TRP A 279
ALA A  10
VAL A   8
 None
 0.82A 1kqeA-4gxwA:
undetectable
1kqeE-4gxwA:
undetectable		 1kqeA-4gxwA:
3.32
1kqeE-4gxwA:
3.32
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.
4h2h MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME

(Salipiger
bermudensis) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		3 TRP A 295
ALA A 327
VAL A  15
 None
 0.86A 1kqeA-4h2hA:
undetectable
1kqeE-4h2hA:
undetectable		 1kqeA-4h2hA:
3.02
1kqeE-4h2hA:
3.02
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.
4hzp BIFUNCTIONAL
METHYLMALONYL-COA:AC
P
ACYLTRANSFERASE/DECA
RBOXYLASE

(Streptomyces
atroolivaceus) 		no annotation 3 TRP A  37
ALA A  16
VAL A  89
 None
 0.89A 1kqeA-4hzpA:
undetectable
1kqeE-4hzpA:
undetectable		 1kqeA-4hzpA:
3.57
1kqeE-4hzpA:
3.57
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.
4izg MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME,
N-TERMINAL DOMAIN
PROTEIN

(Paracoccus
denitrificans) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		3 TRP A 296
ALA A 328
VAL A  15
 None
 0.86A 1kqeA-4izgA:
undetectable
1kqeE-4izgA:
undetectable		 1kqeA-4izgA:
5.59
1kqeE-4izgA:
5.59
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.
4j3z MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME

(Jannaschia sp.
CCS1) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		3 TRP A 318
ALA A 358
VAL A 352
 None
 0.87A 1kqeA-4j3zA:
undetectable
1kqeE-4j3zA:
undetectable		 1kqeA-4j3zA:
2.42
1kqeE-4j3zA:
2.42
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.
4jnd CA(2+)/CALMODULIN-DE
PENDENT PROTEIN
KINASE PHOSPHATASE

(Caenorhabditis
elegans) 		PF00481
(PP2C) 		3 TRP A  92
ALA A  98
VAL A  93
 None
 0.81A 1kqeA-4jndA:
undetectable
1kqeE-4jndA:
undetectable		 1kqeA-4jndA:
2.13
1kqeE-4jndA:
2.13
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.
4lzh L,D-TRANSPEPTIDASE

(Klebsiella
pneumoniae) 		PF03734
(YkuD) 		3 TRP A 149
ALA A 168
VAL A 170
 None
 0.82A 1kqeA-4lzhA:
undetectable
1kqeE-4lzhA:
undetectable		 1kqeA-4lzhA:
7.87
1kqeE-4lzhA:
7.87
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.
4m8u OLIGO-1,6-GLUCOSIDAS
E 1

(Bacillus
subtilis) 		PF00128
(Alpha-amylase)
PF16657
(Malt_amylase_C) 		3 TRP A 172
ALA A 200
VAL A 100
 None
TRS  A 601 ( 4.0A)
None
 0.80A 1kqeA-4m8uA:
undetectable
1kqeE-4m8uA:
undetectable		 1kqeA-4m8uA:
6.63
1kqeE-4m8uA:
6.63
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.
4mag SIALIC ACID BINDING
PROTEIN

(Vibrio cholerae) 		PF03480
(DctP) 		3 TRP A 120
ALA A  65
VAL A 214
 None
 0.80A 1kqeA-4magA:
undetectable
1kqeE-4magA:
undetectable		 1kqeA-4magA:
4.05
1kqeE-4magA:
4.05
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.
4o7p MALTOKINASE

(Mycobacterium
tuberculosis) 		no annotation 3 TRP A 392
ALA A 398
VAL A 393
 None
 0.77A 1kqeA-4o7pA:
undetectable
1kqeE-4o7pA:
undetectable		 1kqeA-4o7pA:
2.06
1kqeE-4o7pA:
2.06
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.
4otm SERINE/THREONINE-PRO
TEIN KINASE GCN2

(Saccharomyces
cerevisiae) 		PF12745
(HGTP_anticodon2) 		3 TRP A1560
ALA A1566
VAL A1561
 None
 0.76A 1kqeA-4otmA:
undetectable
1kqeE-4otmA:
undetectable		 1kqeA-4otmA:
7.14
1kqeE-4otmA:
7.14
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.
4s38 4-HYDROXY-3-METHYLBU
T-2-EN-1-YL
DIPHOSPHATE SYNTHASE

(Thermus
thermophilus) 		PF04551
(GcpE) 		3 TRP A 213
ALA A 219
VAL A 214
 None
 0.80A 1kqeA-4s38A:
undetectable
1kqeE-4s38A:
undetectable		 1kqeA-4s38A:
2.97
1kqeE-4s38A:
2.97
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.
4trg SIDC

(Legionella
pneumophila) 		no annotation 3 TRP A 323
ALA A 316
VAL A 318
 None
 0.82A 1kqeA-4trgA:
undetectable
1kqeE-4trgA:
undetectable		 1kqeA-4trgA:
3.05
1kqeE-4trgA:
3.05
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.
4u98 MALTOKINASE

(Mycolicibacterium
vanbaalenii) 		PF01636
(APH) 		3 TRP A 379
ALA A 385
VAL A 380
 None
 0.75A 1kqeA-4u98A:
undetectable
1kqeE-4u98A:
undetectable		 1kqeA-4u98A:
1.87
1kqeE-4u98A:
1.87
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.
4wrw URACIL-DNA
GLYCOSYLASE

(Mycobacterium
tuberculosis) 		PF03167
(UDG) 		3 TRP A 145
ALA A  52
VAL A  49
 None
 0.84A 1kqeA-4wrwA:
undetectable
1kqeE-4wrwA:
undetectable		 1kqeA-4wrwA:
8.64
1kqeE-4wrwA:
8.64
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.
4xhb SIALIDASE B

(Streptococcus
pneumoniae) 		PF02012
(BNR)
PF02973
(Sialidase)
PF13088
(BNR_2) 		3 TRP A 308
ALA A 241
VAL A 306
 None
 0.71A 1kqeA-4xhbA:
undetectable
1kqeE-4xhbA:
undetectable		 1kqeA-4xhbA:
1.44
1kqeE-4xhbA:
1.44
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.
4xwh ALPHA-N-ACETYLGLUCOS
AMINIDASE

(Homo sapiens) 		PF05089
(NAGLU)
PF12971
(NAGLU_N)
PF12972
(NAGLU_C) 		3 TRP A 474
ALA A 480
VAL A 475
 None
 0.87A 1kqeA-4xwhA:
undetectable
1kqeE-4xwhA:
undetectable		 1kqeA-4xwhA:
1.77
1kqeE-4xwhA:
1.77
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.
4z1p CELL WALL SURFACE
ANCHOR PROTEIN

(Streptococcus
agalactiae) 		PF16364
(Antigen_C) 		3 TRP A 206
ALA A 210
VAL A 208
 None
 0.73A 1kqeA-4z1pA:
undetectable
1kqeE-4z1pA:
undetectable		 1kqeA-4z1pA:
3.74
1kqeE-4z1pA:
3.74
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.
4z23 CELL WALL SURFACE
ANCHOR PROTEIN

(Streptococcus
agalactiae) 		PF16364
(Antigen_C) 		3 TRP A 206
ALA A 210
VAL A 208
 None
 0.79A 1kqeA-4z23A:
undetectable
1kqeE-4z23A:
undetectable		 1kqeA-4z23A:
3.74
1kqeE-4z23A:
3.74
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.
4zfm PUTATIVE
6-PHOSPHO-BETA-GALAC
TOBIOSIDASE

(Geobacillus
stearothermophilus) 		PF00232
(Glyco_hydro_1) 		3 TRP A 466
ALA A 476
VAL A 470
 None
 0.80A 1kqeA-4zfmA:
undetectable
1kqeE-4zfmA:
undetectable		 1kqeA-4zfmA:
2.19
1kqeE-4zfmA:
2.19
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.
5a29 EXOPOLYGALACTURONATE
LYASE

(Vibrio
vulnificus) 		PF06917
(Pectate_lyase_2) 		3 TRP A 184
ALA A 179
VAL A 181
 None
 0.85A 1kqeA-5a29A:
undetectable
1kqeE-5a29A:
undetectable		 1kqeA-5a29A:
2.75
1kqeE-5a29A:
2.75
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.
5bp1 MYCOCEROSIC ACID
SYNTHASE

(Mycolicibacterium
smegmatis) 		PF00109
(ketoacyl-synt)
PF00698
(Acyl_transf_1)
PF02801
(Ketoacyl-synt_C)
PF16197
(KAsynt_C_assoc) 		3 TRP A 716
ALA A 682
VAL A 677
 None
 0.84A 1kqeA-5bp1A:
undetectable
1kqeE-5bp1A:
undetectable		 1kqeA-5bp1A:
1.63
1kqeE-5bp1A:
1.63
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.
5cho FLAVIN REDUCTASE

(uncultured
bacterium) 		PF01613
(Flavin_Reduct) 		3 TRP A 152
ALA A 154
VAL A 164
 None
 0.87A 1kqeA-5choA:
undetectable
1kqeE-5choA:
undetectable		 1kqeA-5choA:
7.69
1kqeE-5choA:
7.69
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.
5csu 4-ALPHA-GLUCANOTRANS
FERASE DPE1,
CHLOROPLASTIC/AMYLOP
LASTIC

(Arabidopsis
thaliana) 		PF02446
(Glyco_hydro_77) 		3 TRP A 338
ALA A 383
VAL A 326
 HMC  A 606 ( 3.6A)
None
None
 0.79A 1kqeA-5csuA:
undetectable
1kqeE-5csuA:
undetectable		 1kqeA-5csuA:
4.44
1kqeE-5csuA:
4.44
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.
5dgt BENZOYLFORMATE
DECARBOXYLASE

(Pseudomonas
putida) 		PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N) 		3 TRP A 163
ALA A  96
VAL A 158
 None
 0.85A 1kqeA-5dgtA:
undetectable
1kqeE-5dgtA:
undetectable		 1kqeA-5dgtA:
2.38
1kqeE-5dgtA:
2.38
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.
5g5u BETA-HEXOSAMINIDASE

(Pseudomonas
aeruginosa) 		PF00933
(Glyco_hydro_3) 		3 TRP A 226
ALA A 181
VAL A 215
 None
 0.85A 1kqeA-5g5uA:
undetectable
1kqeE-5g5uA:
undetectable		 1kqeA-5g5uA:
3.30
1kqeE-5g5uA:
3.30
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.
5gn5 GLYCEROL KINASE

(Trypanosoma
brucei) 		PF00370
(FGGY_N)
PF02782
(FGGY_C) 		3 TRP A 465
ALA A 461
VAL A 464
 None
 0.86A 1kqeA-5gn5A:
undetectable
1kqeE-5gn5A:
undetectable		 1kqeA-5gn5A:
1.56
1kqeE-5gn5A:
1.56
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.
5irp ALANINE RACEMASE 2

(Bacillus
subtilis) 		PF00842
(Ala_racemase_C)
PF01168
(Ala_racemase_N) 		3 TRP A 163
ALA A 157
VAL A 152
 None
 0.87A 1kqeA-5irpA:
undetectable
1kqeE-5irpA:
undetectable		 1kqeA-5irpA:
2.11
1kqeE-5irpA:
2.11
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.
5na7 PUTATIVE
DIPEPTIDYL-PEPTIDASE
III

(Bacteroides
thetaiotaomicron) 		no annotation 3 TRP A 543
ALA A 549
VAL A 544
 None
 0.74A 1kqeA-5na7A:
undetectable
1kqeE-5na7A:
undetectable		 1kqeA-5na7A:
3.44
1kqeE-5na7A:
3.44
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.
5njf METALLOPROTEASE PMBA

(Escherichia
coli) 		PF01523
(PmbA_TldD) 		3 TRP B 221
ALA B 227
VAL B 222
 None
 0.81A 1kqeA-5njfB:
undetectable
1kqeE-5njfB:
undetectable		 1kqeA-5njfB:
2.41
1kqeE-5njfB:
2.41
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.
5nl7 CALPONIN HOMOLOGY
DOMAIN PROTEIN
PUTATIVE

(Entamoeba
histolytica) 		no annotation 3 TRP A  21
ALA A  27
VAL A  22
 None
 0.81A 1kqeA-5nl7A:
undetectable
1kqeE-5nl7A:
undetectable		 1kqeA-5nl7A:
undetectable
1kqeE-5nl7A:
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.
5uxb MACROLIDE
2'-PHOSPHOTRANSFERAS
E MPHH

(Brachybacterium
faecium) 		PF01636
(APH) 		3 TRP A 215
ALA A  77
VAL A 212
 None
 0.84A 1kqeA-5uxbA:
undetectable
1kqeE-5uxbA:
undetectable		 1kqeA-5uxbA:
4.02
1kqeE-5uxbA:
4.02
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.
5vm1 XYLULOKINASE

(Brucella ovis) 		PF00370
(FGGY_N)
PF02782
(FGGY_C) 		3 TRP A 135
ALA A 141
VAL A 136
 None
 0.87A 1kqeA-5vm1A:
undetectable
1kqeE-5vm1A:
undetectable		 1kqeA-5vm1A:
5.70
1kqeE-5vm1A:
5.70
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.
5vwn TRIOSEPHOSPHATE
ISOMERASE

(Trichomonas
vaginalis) 		no annotation 3 TRP A 152
ALA A 193
VAL A 191
 None
 0.74A 1kqeA-5vwnA:
undetectable
1kqeE-5vwnA:
undetectable		 1kqeA-5vwnA:
undetectable
1kqeE-5vwnA:
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.
5yj6 DOCKERIN TYPE I
REPEAT-CONTAINING
PROTEIN

(Ruminiclostridium
thermocellum) 		no annotation 3 TRP A 358
ALA A 367
VAL A 359
 None
 0.89A 1kqeA-5yj6A:
undetectable
1kqeE-5yj6A:
undetectable		 1kqeA-5yj6A:
undetectable
1kqeE-5yj6A:
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.
5z6v ABC-TYPE
UNCHARACTERIZED
TRANSPORT SYSTEM
PERIPLASMIC
COMPONENT-LIKE
PROTEIN

(Rhodothermus
marinus) 		no annotation 3 TRP A 148
ALA A 144
VAL A 146
 None
 0.87A 1kqeA-5z6vA:
undetectable
1kqeE-5z6vA:
undetectable		 1kqeA-5z6vA:
undetectable
1kqeE-5z6vA:
undetectable