SIMILAR PATTERNS OF AMINO ACIDS FOR 3FL9_H_TOPH200_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.
1b25 PROTEIN
(FORMALDEHYDE
FERREDOXIN
OXIDOREDUCTASE)

(Pyrococcus
furiosus) 		PF01314
(AFOR_C)
PF02730
(AFOR_N) 		5 ALA A  97
ILE A 121
LEU A 196
PHE A  60
THR A  95
 None
 1.11A 3fl9H-1b25A:
undetectable		 3fl9H-1b25A:
14.73
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.
1ef9 METHYLMALONYL COA
DECARBOXYLASE

(Escherichia
coli) 		PF00378
(ECH_1) 		5 ALA A 111
VAL A 103
ILE A 177
LEU A 178
PHE A 129
 None
 1.26A 3fl9H-1ef9A:
undetectable		 3fl9H-1ef9A:
19.78
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.
1fnn CELL DIVISION
CONTROL PROTEIN 6

(Pyrobaculum
aerophilum) 		PF09079
(Cdc6_C)
PF13401
(AAA_22) 		5 ALA A  73
LEU A  32
LEU A  60
PHE A  75
THR A  71
 None
 1.29A 3fl9H-1fnnA:
undetectable		 3fl9H-1fnnA:
18.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1hm6 ANNEXIN 1

(Sus scrofa) 		PF00191
(Annexin) 		5 ALA A 179
LEU A 264
VAL A 267
ILE A 224
LEU A 233
 None
 1.32A 3fl9H-1hm6A:
undetectable		 3fl9H-1hm6A:
17.78
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.
1jgs MULTIPLE ANTIBIOTIC
RESISTANCE PROTEIN
MARR

(Escherichia
coli) 		PF01047
(MarR) 		5 ALA A  41
LEU A  78
ILE A  49
LEU A 100
THR A  39
 SAL  A 257 (-3.2A)
None
None
None
SAL  A 257 (-3.5A)
 1.34A 3fl9H-1jgsA:
undetectable		 3fl9H-1jgsA:
20.36
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.
1ks9 2-DEHYDROPANTOATE
2-REDUCTASE

(Escherichia
coli) 		PF02558
(ApbA)
PF08546
(ApbA_C) 		5 ALA A  79
LEU A  67
VAL A  69
ILE A 109
LEU A 113
 None
 1.31A 3fl9H-1ks9A:
undetectable		 3fl9H-1ks9A:
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.
1n7f AMPA RECEPTOR
INTERACTING PROTEIN
GRIP

(Rattus
norvegicus) 		PF00595
(PDZ) 		5 ALA A 707
LEU A 748
ILE A 686
LEU A 739
THR A 710
 None
 1.31A 3fl9H-1n7fA:
undetectable		 3fl9H-1n7fA:
18.93
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.
1ofe FERREDOXIN-DEPENDENT
GLUTAMATE SYNTHASE 2

(Synechocystis
sp. PCC 6803) 		PF00310
(GATase_2)
PF01493
(GXGXG)
PF01645
(Glu_synthase)
PF04898
(Glu_syn_central) 		5 ALA A 587
LEU A 600
VAL A 564
ILE A 616
THR A 590
 None
 1.09A 3fl9H-1ofeA:
undetectable		 3fl9H-1ofeA:
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.
1p1d GLUTAMATE RECEPTOR
INTERACTING PROTEIN

(Rattus
norvegicus) 		PF00595
(PDZ) 		5 LEU A 109
VAL A  78
ILE A  39
LEU A  72
THR A  86
 None
 1.35A 3fl9H-1p1dA:
undetectable		 3fl9H-1p1dA:
22.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1p68 DE NOVO DESIGNED
PROTEIN S-824

(Escherichia
coli) 		no annotation 5 MET A  60
LEU A  37
VAL A  40
ILE A  92
LEU A   9
 None
 1.11A 3fl9H-1p68A:
undetectable		 3fl9H-1p68A:
20.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1psz PROTEIN (SURFACE
ANTIGEN PSAA)

(Streptococcus
pneumoniae) 		PF01297
(ZnuA) 		5 ALA A  50
LEU A  56
VAL A  35
ILE A  42
PHE A  86
 None
 1.38A 3fl9H-1pszA:
undetectable		 3fl9H-1pszA:
18.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1qdl PROTEIN
(ANTHRANILATE
SYNTHASE
(TRPE-SUBUNIT))

(Sulfolobus
solfataricus) 		PF00425
(Chorismate_bind)
PF04715
(Anth_synt_I_N) 		5 LEU A  62
ILE A  86
LEU A 325
PHE A 372
THR A 114
 None
 1.17A 3fl9H-1qdlA:
undetectable		 3fl9H-1qdlA:
17.81
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.
1rkv HOMOSERINE KINASE

(Pseudomonas
aeruginosa) 		PF12710
(HAD) 		5 ALA A  21
LEU A  50
LEU A 114
PHE A  96
THR A  24
 None
 1.34A 3fl9H-1rkvA:
undetectable		 3fl9H-1rkvA:
19.14
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.
1ta3 XYLANASE INHIBITOR
PROTEIN I

(Triticum
aestivum) 		PF00704
(Glyco_hydro_18) 		5 ALA A 175
LEU A 158
ILE A  77
LEU A  99
THR A 178
 None
 1.21A 3fl9H-1ta3A:
undetectable		 3fl9H-1ta3A:
20.91
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.
1tfp TRANSTHYRETIN

(Gallus gallus) 		PF00576
(Transthyretin) 		5 ALA A 109
VAL A  71
ILE A  55
LEU A  58
THR A 118
 None
 1.22A 3fl9H-1tfpA:
undetectable		 3fl9H-1tfpA:
17.18
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.
1xec DECORIN

(Bos taurus) 		PF01462
(LRRNT)
PF13855
(LRR_8) 		5 MET A 119
LEU A 112
ILE A  67
LEU A  83
PHE A  96
 None
 1.26A 3fl9H-1xecA:
undetectable		 3fl9H-1xecA:
20.36
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.
1zjj HYPOTHETICAL PROTEIN
PH1952

(Pyrococcus
horikoshii) 		PF13242
(Hydrolase_like)
PF13344
(Hydrolase_6) 		5 VAL A 253
ILE A  26
LEU A  29
PHE A   6
THR A 231
 None
 1.35A 3fl9H-1zjjA:
undetectable		 3fl9H-1zjjA:
20.91
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.
2aw5 NADP-DEPENDENT MALIC
ENZYME

(Homo sapiens) 		PF00390
(malic)
PF03949
(Malic_M) 		5 GLU A  63
VAL A  59
ILE A 100
LEU A  75
PHE A  97
 None
 1.30A 3fl9H-2aw5A:
undetectable		 3fl9H-2aw5A:
14.49
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.
2csu 457AA LONG
HYPOTHETICAL PROTEIN

(Pyrococcus
horikoshii) 		PF13380
(CoA_binding_2)
PF13607
(Succ_CoA_lig) 		5 ALA A 264
VAL A 270
ILE A 210
LEU A 208
PHE A 219
 None
 1.31A 3fl9H-2csuA:
2.1		 3fl9H-2csuA:
15.25
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.
2cw7 ENDONUCLEASE
PI-PKOII

(Thermococcus
kodakarensis) 		PF14528
(LAGLIDADG_3)
PF14890
(Intein_splicing) 		5 GLU A  12
LEU A  50
VAL A  10
ILE A  25
LEU A 518
 None
 1.37A 3fl9H-2cw7A:
undetectable		 3fl9H-2cw7A:
15.47
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.
2cxh PROBABLE BRIX-DOMAIN
RIBOSOMAL BIOGENESIS
PROTEIN

(Aeropyrum
pernix) 		no annotation 5 ALA A 123
VAL A 169
ILE A  39
LEU A  35
PHE A 171
 None
 1.32A 3fl9H-2cxhA:
undetectable		 3fl9H-2cxhA:
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.
2g04 PROBABLE
FATTY-ACID-COA
RACEMASE FAR

(Mycobacterium
tuberculosis) 		PF02515
(CoA_transf_3) 		5 ALA A  71
LEU A  63
VAL A  65
ILE A  13
LEU A  15
 None
 1.11A 3fl9H-2g04A:
undetectable		 3fl9H-2g04A:
18.99
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.
2gsz TWITCHING MOTILITY
PROTEIN PILT

(Aquifex
aeolicus) 		PF00437
(T2SSE) 		5 ALA A 246
LEU A 273
ILE A 297
LEU A 131
THR A 249
 None
 1.35A 3fl9H-2gszA:
undetectable		 3fl9H-2gszA:
18.62
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.
2h34 SERINE/THREONINE-PRO
TEIN KINASE PKNE

(Mycobacterium
tuberculosis) 		PF00069
(Pkinase) 		5 ALA A 126
LEU A 201
VAL A 140
ILE A 119
LEU A 101
 None
 1.36A 3fl9H-2h34A:
undetectable		 3fl9H-2h34A:
19.55
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.
2id5 LEUCINE RICH REPEAT
NEURONAL 6A

(Homo sapiens) 		PF07679
(I-set)
PF13306
(LRR_5)
PF13855
(LRR_8) 		5 LEU A 284
VAL A 287
ILE A 277
LEU A 301
PHE A 292
 None
 1.15A 3fl9H-2id5A:
undetectable		 3fl9H-2id5A:
14.68
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.
2im9 HYPOTHETICAL PROTEIN

(Legionella
pneumophila) 		PF07313
(DUF1460) 		5 ALA A 249
ILE A 264
LEU A 319
PHE A 261
THR A 248
 None
 1.12A 3fl9H-2im9A:
undetectable		 3fl9H-2im9A:
17.42
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.
2p4q 6-PHOSPHOGLUCONATE
DEHYDROGENASE,
DECARBOXYLATING 1

(Saccharomyces
cerevisiae) 		PF00393
(6PGD)
PF03446
(NAD_binding_2) 		5 ALA A  54
LEU A  42
VAL A  38
ILE A  18
THR A  55
 None
 1.17A 3fl9H-2p4qA:
undetectable		 3fl9H-2p4qA:
15.85
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2qk8 DIHYDROFOLATE
REDUCTASE

(Bacillus
anthracis) 		PF00186
(DHFR_1) 		5 ALA A   8
GLU A  28
VAL A  32
LEU A  41
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.7A)
None
MTX  A 200 ( 4.4A)
 1.22A 3fl9H-2qk8A:
28.2		 3fl9H-2qk8A:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2qk8 DIHYDROFOLATE
REDUCTASE

(Bacillus
anthracis) 		PF00186
(DHFR_1) 		9 MET A   6
ALA A   8
GLU A  28
LEU A  29
VAL A  32
ILE A  51
LEU A  55
PHE A  96
THR A 115
 MTX  A 200 ( 4.1A)
MTX  A 200 ( 3.4A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.7A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 3.9A)
MTX  A 200 ( 4.4A)
 0.52A 3fl9H-2qk8A:
28.2		 3fl9H-2qk8A:
100.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2r9y ALPHA-2-ANTIPLASMIN

(Mus musculus) 		PF00079
(Serpin) 		5 MET A 275
ALA A 261
LEU A 309
VAL A 384
LEU A 312
 None
 1.19A 3fl9H-2r9yA:
undetectable		 3fl9H-2r9yA:
16.05
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2w9s DIHYDROFOLATE
REDUCTASE TYPE 1
FROM TN4003

(Staphylococcus
aureus) 		PF00186
(DHFR_1) 		6 ALA A   7
LEU A  28
ILE A  50
LEU A  54
PHE A  92
THR A 111
 TOP  A1160 ( 3.6A)
TOP  A1160 ( 4.6A)
TOP  A1160 (-4.4A)
None
TOP  A1160 ( 3.9A)
TOP  A1160 ( 4.5A)
 0.74A 3fl9H-2w9sA:
24.8		 3fl9H-2w9sA:
44.24
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.
2wsm HYDROGENASE
EXPRESSION/FORMATION
PROTEIN (HYPB)

(Archaeoglobus
fulgidus) 		PF02492
(cobW) 		5 ALA A  38
GLU A 141
VAL A 145
ILE A 159
PHE A 153
 None
 1.24A 3fl9H-2wsmA:
3.5		 3fl9H-2wsmA:
22.17
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.
2xkk TOPOISOMERASE IV

(Acinetobacter
baumannii) 		PF00521
(DNA_topoisoIV)
PF00986
(DNA_gyraseB_C)
PF01751
(Toprim) 		5 GLU A1468
LEU A1464
VAL A1362
ILE A1451
LEU A1455
 None
 1.23A 3fl9H-2xkkA:
undetectable		 3fl9H-2xkkA:
11.50
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.
3a5i FLAGELLAR
BIOSYNTHESIS PROTEIN
FLHA

(Salmonella
enterica) 		PF00771
(FHIPEP) 		5 ALA A 644
VAL A 647
ILE A 683
LEU A 677
PHE A 591
 None
 1.31A 3fl9H-3a5iA:
undetectable		 3fl9H-3a5iA:
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.
3bxj RAS
GTPASE-ACTIVATING
PROTEIN SYNGAP

(Rattus
norvegicus) 		PF00168
(C2)
PF00616
(RasGAP) 		5 LEU A 436
VAL A 409
LEU A 681
PHE A 405
THR A 443
 None
 1.37A 3fl9H-3bxjA:
undetectable		 3fl9H-3bxjA:
16.34
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.
3cr3 PTS-DEPENDENT
DIHYDROXYACETONE
KINASE, ADP-BINDING
SUBUNIT DHAL

(Lactococcus
lactis) 		PF02734
(Dak2) 		5 LEU A 187
VAL A 191
ILE A 104
LEU A 135
THR A   6
 None
 1.35A 3fl9H-3cr3A:
undetectable		 3fl9H-3cr3A:
20.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3dh3 RIBOSOMAL LARGE
SUBUNIT
PSEUDOURIDINE
SYNTHASE F

(Escherichia
coli) 		PF00849
(PseudoU_synth_2)
PF01479
(S4) 		5 GLU A 228
VAL A 211
ILE A 126
PHE A 115
THR A 225
 None
 1.33A 3fl9H-3dh3A:
undetectable		 3fl9H-3dh3A:
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.
3dwk PENICILLIN-BINDING
PROTEIN 2

(Staphylococcus
aureus) 		PF00905
(Transpeptidase)
PF00912
(Transgly) 		5 ALA A 207
LEU A 230
ILE A 239
LEU A 276
PHE A 212
 None
 1.21A 3fl9H-3dwkA:
undetectable		 3fl9H-3dwkA:
14.55
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.
3e9m OXIDOREDUCTASE,
GFO/IDH/MOCA FAMILY

(Enterococcus
faecalis) 		PF01408
(GFO_IDH_MocA) 		5 ALA A 122
GLU A 280
ILE A  68
LEU A 288
PHE A 118
 None
 1.31A 3fl9H-3e9mA:
undetectable		 3fl9H-3e9mA:
17.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3f0h AMINOTRANSFERASE

([Eubacterium]
rectale) 		PF00266
(Aminotran_5) 		5 ALA A 299
LEU A 351
ILE A 316
LEU A 344
THR A 298
 None
 1.26A 3fl9H-3f0hA:
undetectable		 3fl9H-3f0hA:
17.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ft9 PHL P 3 ALLERGEN

(Phleum pratense) 		PF01357
(Pollen_allerg_1) 		5 GLU A  44
LEU A  35
VAL A  55
ILE A  83
LEU A  19
 None
 1.19A 3fl9H-3ft9A:
undetectable		 3fl9H-3ft9A:
21.34
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.
3gju PUTATIVE
AMINOTRANSFERASE

(Mesorhizobium
japonicum) 		PF00202
(Aminotran_3) 		5 VAL A 334
ILE A 103
LEU A 291
PHE A 116
THR A  93
 None
 1.30A 3fl9H-3gjuA:
undetectable		 3fl9H-3gjuA:
16.23
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.
3gle PILIN

(Streptococcus
pyogenes) 		PF12892
(FctA) 		5 LEU A 175
VAL A 177
ILE A 212
PHE A 235
THR A 287
 LEU  A 175 ( 0.5A)
VAL  A 177 ( 0.6A)
ILE  A 212 ( 0.7A)
PHE  A 235 ( 1.3A)
THR  A 287 ( 0.8A)
 1.28A 3fl9H-3gleA:
undetectable		 3fl9H-3gleA:
17.63
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.
3hm4 CHEMOTAXIS PROTEIN
CHEX

(Desulfovibrio
alaskensis) 		PF13690
(CheX) 		5 ALA A  15
LEU A 106
ILE A  51
LEU A 154
THR A  14
 None
 1.29A 3fl9H-3hm4A:
undetectable		 3fl9H-3hm4A:
22.81
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3i8a DIHYDROFOLATE
REDUCTASE

(Staphylococcus
aureus) 		PF00186
(DHFR_1) 		6 ALA X   7
VAL X  31
ILE X  50
LEU X  54
PHE X  92
THR X 111
 N22  X 219 ( 3.6A)
None
N22  X 219 (-4.6A)
None
N22  X 219 ( 3.7A)
N22  X 219 (-4.4A)
 0.77A 3fl9H-3i8aX:
25.0		 3fl9H-3i8aX:
46.34
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3i8a DIHYDROFOLATE
REDUCTASE

(Staphylococcus
aureus) 		PF00186
(DHFR_1) 		6 LEU X  28
VAL X  31
ILE X  50
LEU X  54
PHE X  92
THR X 111
 N22  X 219 (-4.4A)
None
N22  X 219 (-4.6A)
None
N22  X 219 ( 3.7A)
N22  X 219 (-4.4A)
 0.75A 3fl9H-3i8aX:
25.0		 3fl9H-3i8aX:
46.34
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ia4 DIHYDROFOLATE
REDUCTASE

(Moritella
profunda) 		PF00186
(DHFR_1) 		6 ALA A   8
GLU A  28
LEU A  29
ILE A  51
LEU A  55
THR A 115
 MTX  A 164 ( 3.7A)
MTX  A 164 (-2.9A)
MTX  A 164 (-4.0A)
MTX  A 164 (-4.1A)
MTX  A 164 ( 4.4A)
MTX  A 164 (-4.3A)
 0.70A 3fl9H-3ia4A:
25.8		 3fl9H-3ia4A:
44.85
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.
3ief TRNA
(GUANINE-N(1)-)-METH
YLTRANSFERASE

(Bartonella
henselae) 		PF01746
(tRNA_m1G_MT) 		5 ALA A 142
LEU A  92
VAL A 129
ILE A 150
LEU A 100
 None
 1.18A 3fl9H-3iefA:
undetectable		 3fl9H-3iefA:
22.50
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ix9 DIHYDROFOLATE
REDUCTASE

(Streptococcus
pneumoniae) 		PF00186
(DHFR_1) 		5 ALA A  10
GLU A  30
LEU A  31
LEU A  58
THR A 119
 MTX  A 200 (-3.8A)
MTX  A 200 (-2.7A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.0A)
MTX  A 200 ( 4.5A)
 0.68A 3fl9H-3ix9A:
24.6		 3fl9H-3ix9A:
36.98
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.
3jcm U4/U6 SMALL NUCLEAR
RIBONUCLEOPROTEIN
PRP4

(Saccharomyces
cerevisiae) 		PF00400
(WD40) 		5 GLU B 116
LEU B 117
ILE B 336
LEU B 124
PHE B 279
 None
 1.32A 3fl9H-3jcmB:
undetectable		 3fl9H-3jcmB:
15.40
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.
3js8 CHOLESTEROL OXIDASE

(Chromobacterium
sp. DS-1) 		PF01565
(FAD_binding_4)
PF09129
(Chol_subst-bind) 		5 ALA A  49
LEU A  82
VAL A  80
ILE A  12
PHE A   8
 None
 1.16A 3fl9H-3js8A:
undetectable		 3fl9H-3js8A:
15.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ktn CARBOHYDRATE KINASE,
PFKB FAMILY

(Enterococcus
faecalis) 		PF00294
(PfkB) 		5 ALA A 301
LEU A 254
ILE A 194
PHE A 196
THR A 302
 None
 1.30A 3fl9H-3ktnA:
undetectable		 3fl9H-3ktnA:
18.29
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.
3l8k DIHYDROLIPOYL
DEHYDROGENASE

(Sulfolobus
solfataricus) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		5 ALA A 186
LEU A 222
ILE A 347
LEU A 206
THR A 196
 None
 1.22A 3fl9H-3l8kA:
undetectable		 3fl9H-3l8kA:
14.83
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.
3m07 PUTATIVE ALPHA
AMYLASE

(Salmonella
enterica) 		PF00128
(Alpha-amylase)
PF11941
(DUF3459) 		5 ALA A 132
VAL A 149
ILE A 185
LEU A 255
PHE A 181
 None
 1.21A 3fl9H-3m07A:
undetectable		 3fl9H-3m07A:
12.78
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.
3pdw UNCHARACTERIZED
HYDROLASE YUTF

(Bacillus
subtilis) 		PF13242
(Hydrolase_like)
PF13344
(Hydrolase_6) 		5 LEU A 204
VAL A 206
ILE A 258
LEU A  34
PHE A  30
 None
 0.93A 3fl9H-3pdwA:
undetectable		 3fl9H-3pdwA:
20.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3rd8 FUMARATE HYDRATASE
CLASS II

(Mycolicibacterium
smegmatis) 		PF00206
(Lyase_1)
PF10415
(FumaraseC_C) 		5 ALA A 335
LEU A 374
VAL A 377
ILE A 205
LEU A 164
 None
 1.37A 3fl9H-3rd8A:
undetectable		 3fl9H-3rd8A:
16.18
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.
3s4w FANCONI ANEMIA GROUP
D2 PROTEIN HOMOLOG

(Mus musculus) 		PF14631
(FancD2) 		5 MET B 150
LEU B 112
ILE B 175
LEU B 178
THR B 102
 None
 1.32A 3fl9H-3s4wB:
undetectable		 3fl9H-3s4wB:
8.23
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.
3siu U4/U6 SMALL NUCLEAR
RIBONUCLEOPROTEIN
PRP31

(Homo sapiens) 		PF01798
(Nop) 		5 ALA B 171
LEU B 142
ILE B 164
LEU B 159
THR B 174
 None
 1.19A 3fl9H-3siuB:
undetectable		 3fl9H-3siuB:
24.19
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.
3sqn CONSERVED DOMAIN
PROTEIN

(Enterococcus
faecalis) 		PF05043
(Mga) 		5 ALA A 387
LEU A 300
VAL A 297
LEU A 360
THR A 312
 None
 1.38A 3fl9H-3sqnA:
undetectable		 3fl9H-3sqnA:
15.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3tkt CYTOCHROME P450

(Novosphingobium
aromaticivorans) 		PF00067
(p450) 		5 ALA A 241
VAL A 174
ILE A 264
LEU A 185
PHE A 225
 None
 1.37A 3fl9H-3tktA:
undetectable		 3fl9H-3tktA:
17.04
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3tq9 DIHYDROFOLATE
REDUCTASE

(Coxiella
burnetii) 		PF00186
(DHFR_1) 		5 ALA A   8
LEU A  29
ILE A  51
LEU A  55
THR A 115
 MTX  A2001 ( 3.4A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-4.3A)
 0.58A 3fl9H-3tq9A:
24.7		 3fl9H-3tq9A:
38.20
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.
3unv ADMH

(Pantoea
agglomerans) 		PF00221
(Lyase_aromatic) 		5 ALA A 487
LEU A 506
VAL A 246
ILE A 530
LEU A 535
 None
 1.34A 3fl9H-3unvA:
undetectable		 3fl9H-3unvA:
14.34
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.
3wsu BETA-MANNANASE

(Streptomyces
thermolilacinus) 		PF00150
(Cellulase) 		5 ALA A 345
GLU A  63
LEU A  54
LEU A 240
THR A 346
 None
 1.29A 3fl9H-3wsuA:
undetectable		 3fl9H-3wsuA:
15.32
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.
4a6q HISTONE DEACETYLASE
COMPLEX SUBUNIT
SAP18

(Mus musculus) 		PF06487
(SAP18) 		5 MET A  62
ALA A  64
LEU A 133
ILE A 106
THR A  60
 None
 1.22A 3fl9H-4a6qA:
undetectable		 3fl9H-4a6qA:
20.12
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.
4a8j ELONGATOR COMPLEX
PROTEIN 4

(Saccharomyces
cerevisiae) 		PF05625
(PAXNEB) 		5 MET A 347
LEU A 310
ILE A 288
LEU A 291
PHE A 348
 None
 1.31A 3fl9H-4a8jA:
undetectable		 3fl9H-4a8jA:
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.
4c30 DNA HELICASE II

(Deinococcus
radiodurans) 		PF00580
(UvrD-helicase)
PF13361
(UvrD_C) 		5 ALA A 402
LEU A 487
VAL A 490
ILE A 395
LEU A 514
 None
 1.20A 3fl9H-4c30A:
undetectable		 3fl9H-4c30A:
13.23
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.
4eme M18 ASPARTYL
AMINOPEPTIDASE

(Plasmodium
falciparum) 		PF02127
(Peptidase_M18) 		5 LEU A 153
VAL A 152
ILE A  95
LEU A 281
THR A 306
 None
 1.27A 3fl9H-4emeA:
undetectable		 3fl9H-4emeA:
14.01
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.
4f4c MULTIDRUG RESISTANCE
PROTEIN PGP-1

(Caenorhabditis
elegans) 		PF00005
(ABC_tran)
PF00664
(ABC_membrane) 		5 ALA A 761
ILE A 870
LEU A 744
PHE A 874
THR A 762
 None
 1.32A 3fl9H-4f4cA:
2.1		 3fl9H-4f4cA:
7.95
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.
4gbq GRB2

(Mus musculus) 		PF00018
(SH3_1) 		5 ALA A  11
GLU A  16
LEU A  25
PHE A  19
THR A  12
 None
 1.36A 3fl9H-4gbqA:
undetectable		 3fl9H-4gbqA:
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.
4jkg PRE-MRNA-PROCESSING-
SPLICING FACTOR 8

(Homo sapiens) 		PF12134
(PRP8_domainIV) 		5 MET B1868
ALA B1842
VAL B1780
ILE B1882
THR B1841
 None
 1.36A 3fl9H-4jkgB:
undetectable		 3fl9H-4jkgB:
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.
4jmq BACTERIOPHAGE T5
DISTAL TAIL PROTEIN

(Escherichia
virus T5) 		no annotation 5 GLU A 164
LEU A 129
ILE A 150
LEU A 152
THR A 161
 None
 1.37A 3fl9H-4jmqA:
undetectable		 3fl9H-4jmqA:
21.53
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.
4jz7 CARBAMATE KINASE

(Giardia
intestinalis) 		PF00696
(AA_kinase) 		5 ALA A  45
LEU A 305
VAL A 302
ILE A   9
LEU A 235
 None
 1.07A 3fl9H-4jz7A:
1.8		 3fl9H-4jz7A:
17.52
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.
4m73 METHYLTRANSFERASE
MPPJ

(Streptomyces
hygroscopicus) 		PF13649
(Methyltransf_25) 		5 MET A  64
ALA A  26
LEU A  36
LEU A  45
PHE A  65
 None
 1.38A 3fl9H-4m73A:
undetectable		 3fl9H-4m73A:
18.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ol0 TRANSPORTIN-3

(Homo sapiens) 		PF08389
(Xpo1) 		5 ALA B 244
LEU B 228
VAL B 231
ILE B 298
LEU B 276
 None
 1.12A 3fl9H-4ol0B:
undetectable		 3fl9H-4ol0B:
10.97
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.
4toq CLASS III CHITINASE

(Punica granatum) 		PF00704
(Glyco_hydro_18) 		5 ALA A 169
LEU A 153
ILE A  78
LEU A 100
THR A 172
 None
 1.36A 3fl9H-4toqA:
undetectable		 3fl9H-4toqA:
17.22
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.
4w9u ACYL-COA
DEHYDROGENASE

(Brucella
abortus) 		PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M)
PF02771
(Acyl-CoA_dh_N) 		5 GLU A  22
LEU A  84
VAL A  80
ILE A 306
THR A  19
 None
 1.27A 3fl9H-4w9uA:
undetectable		 3fl9H-4w9uA:
16.84
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.
4xb3 GLUCAN
1,6-ALPHA-GLUCOSIDAS
E

(Streptococcus
mutans) 		PF00128
(Alpha-amylase)
PF16657
(Malt_amylase_C) 		5 MET A  20
ILE A  48
LEU A  40
PHE A  19
THR A  22
 None
 1.22A 3fl9H-4xb3A:
undetectable		 3fl9H-4xb3A:
15.54
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.
4xzk PUTATIVE
NAD(+)--ARGININE
ADP-RIBOSYLTRANSFERA
SE VIS

(Vibrio
splendidus) 		PF03496
(ADPrib_exo_Tox) 		5 LEU A 126
VAL A 121
ILE A 202
LEU A 135
PHE A 169
 None
 1.35A 3fl9H-4xzkA:
undetectable		 3fl9H-4xzkA:
21.37
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.
5b04 PROBABLE TRANSLATION
INITIATION FACTOR
EIF-2B SUBUNIT
EPSILON

(Schizosaccharomyces
pombe) 		PF00132
(Hexapep)
PF00483
(NTP_transferase) 		5 ALA I 365
LEU I 384
ILE I 401
LEU I  34
THR I 348
 None
 0.99A 3fl9H-5b04I:
undetectable		 3fl9H-5b04I:
11.80
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.
5d6n ACYL-COA SYNTHASE

(Mycolicibacterium
smegmatis) 		PF00501
(AMP-binding) 		5 ALA A 285
VAL A 310
ILE A 264
LEU A 304
PHE A 325
 None
 1.31A 3fl9H-5d6nA:
undetectable		 3fl9H-5d6nA:
14.59
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.
5eqw PUTATIVE MAJOR COAT
PROTEIN

(Acidianus
tailed spindle
virus) 		no annotation 5 ALA A  37
GLU A  40
VAL A  55
ILE A  62
LEU A 108
 None
 1.19A 3fl9H-5eqwA:
undetectable		 3fl9H-5eqwA:
18.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ey8 ACYL-COA SYNTHASE

(Mycolicibacterium
smegmatis) 		PF00501
(AMP-binding) 		5 ALA A 281
VAL A 310
ILE A 264
LEU A 304
PHE A 325
 None
 1.13A 3fl9H-5ey8A:
undetectable		 3fl9H-5ey8A:
14.60
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.
5ftx SURFACE LAYER
PROTEIN

(Geobacillus
stearothermophilus) 		no annotation 5 ALA A1024
LEU A1011
VAL A1061
ILE A1088
THR A1052
 None
 1.30A 3fl9H-5ftxA:
undetectable		 3fl9H-5ftxA:
11.33
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.
5g5g PUTATIVE XANTHINE
DEHYDROGENASE YAGR
MOLYBDENUM-BINDING
SU SUBUNIT

(Escherichia
coli) 		PF00941
(FAD_binding_5)
PF03450
(CO_deh_flav_C) 		5 ALA B 110
LEU B  56
VAL B  51
ILE B 179
THR B 108
 FAD  B 321 (-3.5A)
None
None
None
FAD  B 321 (-2.9A)
 1.38A 3fl9H-5g5gB:
undetectable		 3fl9H-5g5gB:
18.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5h1y PROBABLE
ATP-DEPENDENT RNA
HELICASE DDX41

(Homo sapiens) 		PF00270
(DEAD) 		5 ALA A 389
LEU A 343
ILE A 361
LEU A 261
PHE A 365
 None
 1.31A 3fl9H-5h1yA:
undetectable		 3fl9H-5h1yA:
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.
5hdh TOLL-LIKE RECEPTOR 8

(Homo sapiens) 		PF13855
(LRR_8) 		5 ALA A 549
LEU A 542
ILE A 496
LEU A 512
PHE A 526
 None
 1.24A 3fl9H-5hdhA:
undetectable		 3fl9H-5hdhA:
11.83
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.
5msx PUTATIVE
ENDO-1,4-BETA-XYLANA
SE

(Bacteroides
thetaiotaomicron) 		PF00754
(F5_F8_type_C)
PF04616
(Glyco_hydro_43) 		5 ALA A  38
LEU A  30
VAL A 291
LEU A 315
PHE A 265
 None
 1.24A 3fl9H-5msxA:
undetectable		 3fl9H-5msxA:
15.69
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.
5nbs BETA-GLUCOSIDASE

(Neurospora
crassa) 		no annotation 5 ALA A 563
LEU A 407
ILE A 578
LEU A 461
THR A 562
 None
None
None
None
NAG  A1130 ( 4.9A)
 1.30A 3fl9H-5nbsA:
undetectable		 3fl9H-5nbsA:
17.61
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.
5o2u CAPSID PROTEIN P24
VHH 59H10

(Human
immunodeficiency
virus 1;
Lama glama) 		PF00607
(Gag_p24)
PF07686
(V-set) 		5 ALA A 209
GLU A 213
VAL B  58
PHE B  47
THR A 210
 None
 1.21A 3fl9H-5o2uA:
undetectable		 3fl9H-5o2uA:
14.08
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.
5osn CAPSID PROTEIN

(Enterovirus E) 		PF00073
(Rhv) 		5 MET A 247
ALA B 161
LEU C  98
VAL C 101
LEU A 104
 None
 1.32A 3fl9H-5osnA:
undetectable		 3fl9H-5osnA:
18.68
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.
5te9 RESPONSE REGULATOR
RECEIVER PROTEIN

(Paraburkholderia
phymatum) 		PF00072
(Response_reg) 		5 ALA A  28
LEU A  38
ILE A  67
LEU A  65
PHE A 128
 None
 1.20A 3fl9H-5te9A:
undetectable		 3fl9H-5te9A:
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.
5wyp DNA POLYMERASE III
SUBUNIT BETA

(Caulobacter
vibrioides) 		no annotation 5 ALA A  37
LEU A  89
ILE A  33
LEU A  14
PHE A  44
 None
 1.17A 3fl9H-5wypA:
undetectable		 3fl9H-5wypA:
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.
5y2v RUBISCO OPERON
TRANSCRIPTIONAL
REGULATOR

(Synechocystis
sp. PCC 6803) 		no annotation 6 ALA A 204
VAL A 240
ILE A 184
LEU A 187
PHE A 209
THR A 201
 None
None
None
None
None
PO4  A 401 (-4.0A)
 1.24A 3fl9H-5y2vA:
undetectable		 3fl9H-5y2vA:
17.37
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.
5y2w RUBISCO OPERON
TRANSCRIPTIONAL
REGULATOR

(Synechocystis
sp. PCC 6803) 		no annotation 5 ALA A 204
VAL A 240
ILE A 184
LEU A 187
PHE A 209
 None
 1.20A 3fl9H-5y2wA:
undetectable		 3fl9H-5y2wA:
22.09
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.
5y2w RUBISCO OPERON
TRANSCRIPTIONAL
REGULATOR

(Synechocystis
sp. PCC 6803) 		no annotation 5 ALA A 204
VAL A 240
ILE A 184
PHE A 209
THR A 201
 None
None
None
None
PGA  A 401 (-3.6A)
 1.19A 3fl9H-5y2wA:
undetectable		 3fl9H-5y2wA:
22.09
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.
6c66 CRISPR-ASSOCIATED
PROTEIN, CSE1 FAMILY

(Thermobifida
fusca) 		no annotation 5 ALA A 426
GLU A 427
ILE A 419
LEU A 399
PHE A 481
 None
 1.27A 3fl9H-6c66A:
undetectable		 3fl9H-6c66A:
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.
6d46 BETA SLIDING CLAMP

(Rickettsia
typhi) 		no annotation 5 LEU A 195
ILE A 219
LEU A 221
PHE A 167
THR A 142
 None
 1.11A 3fl9H-6d46A:
undetectable		 3fl9H-6d46A:
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.
6e4e -

(-) 		no annotation 6 ALA A   7
VAL A  31
ILE A  50
LEU A  54
PHE A  92
THR A 111
 MMV  A 202 ( 3.5A)
MMV  A 202 (-4.9A)
MMV  A 202 ( 4.9A)
None
MMV  A 202 ( 3.5A)
MMV  A 202 (-4.3A)
 0.69A 3fl9H-6e4eA:
25.1		 3fl9H-6e4eA:
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.
6e4e -

(-) 		no annotation 6 LEU A  28
VAL A  31
ILE A  50
LEU A  54
PHE A  92
THR A 111
 MMV  A 202 (-4.2A)
MMV  A 202 (-4.9A)
MMV  A 202 ( 4.9A)
None
MMV  A 202 ( 3.5A)
MMV  A 202 (-4.3A)
 0.61A 3fl9H-6e4eA:
25.1		 3fl9H-6e4eA:
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.
6eq8 PERIPLASMIC
ALPHA-GALACTOSIDE-BI
NDING PROTEIN

(Agrobacterium
tumefaciens) 		no annotation 5 ALA D 385
VAL D 477
ILE D 454
LEU D 451
PHE D 395
 None
 1.35A 3fl9H-6eq8D:
undetectable		 3fl9H-6eq8D:
18.67