SIMILAR PATTERNS OF AMINO ACIDS FOR 3KW4_A_TICA600_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.
1a4e CATALASE A

(Saccharomyces
cerevisiae) 		PF00199
(Catalase)
PF06628
(Catalase-rel) 		5 ILE A 313
PHE A 131
VAL A 231
VAL A 276
GLY A 311
 None
 0.94A 3kw4A-1a4eA:
undetectable		 3kw4A-1a4eA:
22.04
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.
1a76 FLAP ENDONUCLEASE-1
PROTEIN

(Methanocaldococcus
jannaschii) 		PF00752
(XPG_N)
PF00867
(XPG_I) 		5 ILE A 233
ALA A 238
VAL A 250
VAL A 246
GLY A 245
 None
 0.94A 3kw4A-1a76A:
undetectable		 3kw4A-1a76A:
20.41
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.
1amu GRAMICIDIN
SYNTHETASE 1

(Brevibacillus
brevis) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C) 		5 ILE A 348
ILE A 359
GLU A 374
THR A 411
ILE A 377
 None
 0.96A 3kw4A-1amuA:
0.0		 3kw4A-1amuA:
23.45
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.
1d4o NADP(H)
TRANSHYDROGENASE

(Bos taurus) 		PF02233
(PNTB) 		5 ILE A  42
ILE A  60
ILE A  84
VAL A  80
VAL A  85
 None
 0.90A 3kw4A-1d4oA:
0.0		 3kw4A-1d4oA:
18.16
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.
1dm3 BIOSYNTHETIC
THIOLASE ACETYLATED
AT CYS89

(Zoogloea
ramigera) 		PF00108
(Thiolase_N)
PF02803
(Thiolase_C) 		5 ALA A 113
ILE A  35
VAL A  38
VAL A  34
GLY A  31
 None
 0.92A 3kw4A-1dm3A:
0.1		 3kw4A-1dm3A:
20.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1eqc EXO-(B)-(1,3)-GLUCAN
ASE

(Candida
albicans) 		PF00150
(Cellulase) 		5 ILE A 224
ILE A  15
VAL A 289
VAL A 361
GLY A  17
 None
 0.95A 3kw4A-1eqcA:
undetectable		 3kw4A-1eqcA:
20.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1f6d UDP-N-ACETYLGLUCOSAM
INE 2-EPIMERASE

(Escherichia
coli) 		PF02350
(Epimerase_2) 		5 ILE A  74
ALA A 101
THR A 138
VAL A   6
VAL A  90
 None
 0.93A 3kw4A-1f6dA:
0.0		 3kw4A-1f6dA:
23.02
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.
1gz4 NAD-DEPENDENT MALIC
ENZYME

(Homo sapiens) 		PF00390
(malic)
PF03949
(Malic_M) 		5 ILE A 470
ILE A 486
PHE A 491
ALA A 494
VAL A 478
 None
 0.97A 3kw4A-1gz4A:
0.0		 3kw4A-1gz4A:
22.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1hyq CELL DIVISION
INHIBITOR (MIND-1)

(Archaeoglobus
fulgidus) 		PF01656
(CbiA) 		5 ILE A   5
ILE A  19
ILE A 193
VAL A 168
GLY A 194
 None
 0.93A 3kw4A-1hyqA:
0.0		 3kw4A-1hyqA:
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.
1pe9 PECTATE LYASE A

(Dickeya
chrysanthemi) 		PF00544
(Pec_lyase_C) 		5 ILE A  85
ILE A 123
ILE A  59
VAL A  91
VAL A 121
 None
 0.93A 3kw4A-1pe9A:
undetectable		 3kw4A-1pe9A:
21.54
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.
1qjc PHOSPHOPANTETHEINE
ADENYLYLTRANSFERASE

(Escherichia
coli) 		PF01467
(CTP_transf_like) 		5 ILE A  14
ALA A  58
VAL A  67
VAL A  65
GLY A  63
 None
 0.93A 3kw4A-1qjcA:
undetectable		 3kw4A-1qjcA:
14.16
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.
1rx0 ACYL-COA
DEHYDROGENASE FAMILY
MEMBER 8,
MITOCHONDRIAL

(Homo sapiens) 		PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M)
PF02771
(Acyl-CoA_dh_N) 		5 ILE A 178
ILE A  69
THR A 129
VAL A  73
GLY A  74
 None
 0.93A 3kw4A-1rx0A:
0.0		 3kw4A-1rx0A:
21.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1t0i YLR011WP

(Saccharomyces
cerevisiae) 		PF03358
(FMN_red) 		5 ILE A 177
GLU A  28
ILE A   5
VAL A  89
VAL A   3
 None
 0.90A 3kw4A-1t0iA:
undetectable		 3kw4A-1t0iA:
18.00
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.
1txu RAB5 GDP/GTP
EXCHANGE FACTOR

(Homo sapiens) 		PF02204
(VPS9) 		5 ILE A 175
SER A 174
PHE A 341
ALA A 182
GLU A 180
 ILE  A 175 ( 0.3A)
SER  A 174 ( 0.0A)
PHE  A 341 ( 1.3A)
ALA  A 182 ( 0.0A)
GLU  A 180 ( 0.5A)
 0.95A 3kw4A-1txuA:
undetectable		 3kw4A-1txuA:
19.57
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.
1u31 NAD(P)
TRANSHYDROGENASE,
MITOCHONDRIAL

(Homo sapiens) 		PF02233
(PNTB) 		5 ILE A  65
ILE A  83
ILE A 107
VAL A 103
VAL A 108
 None
 0.91A 3kw4A-1u31A:
undetectable		 3kw4A-1u31A:
19.24
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.
1u9l TRANSCRIPTION
ELONGATION PROTEIN
NUSA

(Escherichia
coli) 		no annotation 5 ILE A 365
ILE A 395
PHE A 369
ALA A 370
GLY A 377
 None
 0.96A 3kw4A-1u9lA:
undetectable		 3kw4A-1u9lA:
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.
1udq RIBONUCLEASE PH

(Aquifex
aeolicus) 		PF01138
(RNase_PH)
PF03725
(RNase_PH_C) 		5 ILE A 112
ILE A 150
ALA A 140
ILE A 155
VAL A 102
 None
 0.89A 3kw4A-1udqA:
undetectable		 3kw4A-1udqA:
17.82
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.
1uw4 REGULATOR OF
NONSENSE TRANSCRIPTS
2

(Homo sapiens) 		PF02854
(MIF4G) 		5 ILE B 853
ALA B 872
GLU B 877
ILE B 889
VAL B 884
 None
 0.97A 3kw4A-1uw4B:
undetectable		 3kw4A-1uw4B:
18.26
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.
1v8b ADENOSYLHOMOCYSTEINA
SE

(Plasmodium
falciparum) 		PF00670
(AdoHcyase_NAD)
PF05221
(AdoHcyase) 		5 ILE A 262
ILE A 255
SER A 256
ALA A 273
GLY A 280
 None
 0.96A 3kw4A-1v8bA:
0.5		 3kw4A-1v8bA:
22.45
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.
1wy2 XAA-PRO DIPEPTIDASE

(Pyrococcus
horikoshii) 		PF00557
(Peptidase_M24)
PF01321
(Creatinase_N) 		5 ILE A 185
ALA A 150
ILE A 228
VAL A 209
VAL A 230
 None
 0.93A 3kw4A-1wy2A:
undetectable		 3kw4A-1wy2A:
19.65
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.
1x6d INTERLEUKIN-16

(Homo sapiens) 		PF00595
(PDZ) 		6 ILE A  70
SER A  69
ALA A  55
THR A  19
VAL A  46
VAL A  67
 None
 1.16A 3kw4A-1x6dA:
undetectable		 3kw4A-1x6dA:
14.78
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.
1y0g PROTEIN YCEI

(Escherichia
coli) 		PF04264
(YceI) 		5 ILE A  75
ILE A 161
ILE A 183
VAL A  36
GLY A 159
 8PP  A 320 (-4.2A)
8PP  A 320 (-4.8A)
8PP  A 320 (-4.3A)
8PP  A 320 (-4.7A)
None
 0.94A 3kw4A-1y0gA:
undetectable		 3kw4A-1y0gA:
19.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1z6r MLC PROTEIN

(Escherichia
coli) 		PF00480
(ROK) 		5 ILE A 355
ILE A 245
VAL A 218
VAL A 224
GLY A 246
 None
 0.97A 3kw4A-1z6rA:
undetectable		 3kw4A-1z6rA:
22.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2a1a INTERFERON-INDUCED,
DOUBLE-STRANDED
RNA-ACTIVATED
PROTEIN KINASE

(Homo sapiens) 		PF00069
(Pkinase) 		5 PHE B 421
ILE B 273
VAL B 294
VAL B 281
GLY B 274
 None
 0.91A 3kw4A-2a1aB:
undetectable		 3kw4A-2a1aB:
22.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2aw0 MENKES
COPPER-TRANSPORTING
ATPASE

(Homo sapiens) 		PF00403
(HMA) 		6 ILE A  61
ILE A  34
SER A  33
GLU A   4
THR A   5
VAL A  31
 None
 1.40A 3kw4A-2aw0A:
undetectable		 3kw4A-2aw0A:
12.92
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.
2c1i PEPTIDOGLYCAN GLCNAC
DEACETYLASE

(Streptococcus
pneumoniae) 		PF01522
(Polysacc_deac_1) 		6 SER A 360
GLU A 349
THR A 348
VAL A 313
VAL A 323
GLY A 324
 None
 1.19A 3kw4A-2c1iA:
undetectable		 3kw4A-2c1iA:
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.
2gah HETEROTETRAMERIC
SARCOSINE OXIDASE
ALPHA-SUBUNIT

(Stenotrophomonas
maltophilia) 		PF01571
(GCV_T)
PF07992
(Pyr_redox_2)
PF08669
(GCV_T_C)
PF13510
(Fer2_4) 		6 ILE A 740
ILE A 768
THR A 728
VAL A 799
VAL A 795
GLY A 792
 None
 1.46A 3kw4A-2gahA:
undetectable		 3kw4A-2gahA:
19.84
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.
2k8g POLYADENYLATE-BINDIN
G PROTEIN 1

(Homo sapiens) 		PF00076
(RRM_1) 		6 PHE A 122
ALA A 150
GLU A 156
ILE A 101
VAL A 143
VAL A 170
 None
 1.49A 3kw4A-2k8gA:
undetectable		 3kw4A-2k8gA:
10.50
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.
2qm3 PREDICTED
METHYLTRANSFERASE

(Pyrococcus
furiosus) 		PF01861
(DUF43) 		5 ILE A 279
ILE A 232
ILE A 240
VAL A 236
GLY A 237
 None
 0.91A 3kw4A-2qm3A:
undetectable		 3kw4A-2qm3A:
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.
2qzw CANDIDAPEPSIN-1

(Candida
albicans) 		PF00026
(Asp) 		6 ILE A 126
ILE A 106
SER A 105
ILE A  18
VAL A  99
GLY A 100
 None
 1.46A 3kw4A-2qzwA:
undetectable		 3kw4A-2qzwA:
20.82
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.
2vyw HEMOGLOBIN

(Fasciola
hepatica) 		PF00042
(Globin) 		5 ILE A 133
ILE A  32
THR A  19
ILE A  76
GLY A  72
 None
 0.95A 3kw4A-2vywA:
undetectable		 3kw4A-2vywA:
16.32
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.
2xnf MEDIATOR OF RNA
POLYMERASE II
TRANSCRIPTION
SUBUNIT 25

(Homo sapiens) 		PF11232
(Med25) 		5 ILE A 526
PHE A 500
VAL A 431
VAL A 471
GLY A 524
 None
 0.90A 3kw4A-2xnfA:
undetectable		 3kw4A-2xnfA:
15.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2yln PUTATIVE ABC
TRANSPORTER,
PERIPLASMIC BINDING
PROTEIN, AMINO ACID

(Neisseria
gonorrhoeae) 		PF00497
(SBP_bac_3) 		5 ILE A  45
PHE A 247
VAL A  90
VAL A  88
GLY A  87
 None
 0.84A 3kw4A-2ylnA:
undetectable		 3kw4A-2ylnA:
18.96
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.
2z6i TRANS-2-ENOYL-ACP
REDUCTASE II

(Streptococcus
pneumoniae) 		PF03060
(NMO) 		5 ILE A  55
ILE A 111
VAL A  92
VAL A  89
GLY A  88
 None
 0.97A 3kw4A-2z6iA:
undetectable		 3kw4A-2z6iA:
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.
3b3d PUTATIVE MORPHINE
DEHYDROGENASE

(Bacillus
subtilis) 		PF00248
(Aldo_ket_red) 		5 ILE A 139
ALA A 129
ILE A 115
VAL A  84
GLY A 143
 None
 0.85A 3kw4A-3b3dA:
undetectable		 3kw4A-3b3dA:
21.31
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.
3d3f YVGN PROTEIN

(Bacillus
subtilis) 		PF00248
(Aldo_ket_red) 		5 ILE A 135
ALA A 125
ILE A 111
VAL A  80
GLY A 139
 None
 0.86A 3kw4A-3d3fA:
undetectable		 3kw4A-3d3fA:
21.09
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.
3din PREPROTEIN
TRANSLOCASE SUBUNIT
SECE
PREPROTEIN
TRANSLOCASE SUBUNIT
SECY

(Thermotoga
maritima) 		PF00344
(SecY)
PF00584
(SecE) 		5 ILE C  26
ILE D  58
SER D  56
ILE D  50
GLY D  53
 None
 0.92A 3kw4A-3dinC:
0.6		 3kw4A-3dinC:
23.03
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.
3dzc UDP-N-ACETYLGLUCOSAM
INE 2-EPIMERASE

(Vibrio cholerae) 		PF02350
(Epimerase_2) 		5 ILE A  75
ALA A 102
THR A 139
VAL A   7
VAL A  91
 None
 0.94A 3kw4A-3dzcA:
undetectable		 3kw4A-3dzcA:
22.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3enq RIBOSE-5-PHOSPHATE
ISOMERASE A

(Vibrio
vulnificus) 		PF06026
(Rib_5-P_isom_A) 		6 ILE A  36
SER A  56
ALA A  14
VAL A  24
VAL A  26
GLY A  27
 None
 1.31A 3kw4A-3enqA:
undetectable		 3kw4A-3enqA:
18.98
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.
3etc AMP-BINDING PROTEIN

(Methanosarcina
acetivorans) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C) 		5 ILE A 494
ALA A 470
GLU A 468
VAL A 462
GLY A 463
 None
 0.91A 3kw4A-3etcA:
undetectable		 3kw4A-3etcA:
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.
3ffr PHOSPHOSERINE
AMINOTRANSFERASE
SERC

(Cytophaga
hutchinsonii) 		PF00266
(Aminotran_5) 		5 ILE A 281
ILE A 313
PHE A 287
VAL A 324
GLY A 325
 None
 0.89A 3kw4A-3ffrA:
undetectable		 3kw4A-3ffrA:
21.74
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.
3gl1 HEAT SHOCK PROTEIN
SSB1

(Saccharomyces
cerevisiae) 		PF00012
(HSP70) 		5 ILE A 215
ALA A 180
ILE A 200
VAL A 338
VAL A 198
 None
 0.97A 3kw4A-3gl1A:
undetectable		 3kw4A-3gl1A:
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.
3god CAS1

(Pseudomonas
aeruginosa) 		PF01867
(Cas_Cas1) 		5 ILE A  66
ILE A  52
VAL A  81
VAL A  79
GLY A  78
 None
 0.81A 3kw4A-3godA:
0.2		 3kw4A-3godA:
22.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3h2t BASEPLATE STRUCTURAL
PROTEIN GP6

(Escherichia
virus T4) 		no annotation 5 ILE A 621
ILE A 602
ILE A 592
VAL A 553
GLY A 593
 None
 0.80A 3kw4A-3h2tA:
undetectable		 3kw4A-3h2tA:
20.41
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.
3hn7 UDP-N-ACETYLMURAMATE
-L-ALANINE LIGASE

(Psychrobacter
arcticus) 		PF01225
(Mur_ligase)
PF02875
(Mur_ligase_C)
PF08245
(Mur_ligase_M) 		5 ILE A 466
ILE A 368
ALA A 497
VAL A 370
GLY A 363
 None
 0.94A 3kw4A-3hn7A:
undetectable		 3kw4A-3hn7A:
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.
3ia0 ETHANOLAMINE
UTILIZATION PROTEIN
EUTS

(Escherichia
coli) 		PF00936
(BMC) 		5 ILE A  33
ALA A  40
ILE A  79
VAL A  78
GLY A  68
 None
 0.95A 3kw4A-3ia0A:
undetectable		 3kw4A-3ia0A:
12.39
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.
3igd ENDONUCLEASE PI-MTUI

(Mycobacterium
tuberculosis) 		no annotation 5 ILE A  61
SER A 407
ALA A 433
VAL A  75
VAL A  93
 None
 0.96A 3kw4A-3igdA:
undetectable		 3kw4A-3igdA:
14.50
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.
3it4 ARGININE
BIOSYNTHESIS
BIFUNCTIONAL PROTEIN
ARGJ BETA CHAIN

(Mycobacterium
tuberculosis) 		PF01960
(ArgJ) 		5 ILE B 306
ILE B 335
ALA B 329
ILE B 342
VAL B 375
 None
 0.97A 3kw4A-3it4B:
undetectable		 3kw4A-3it4B:
18.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3j4j TRANSLATION
INITIATION FACTOR
IF-2

(Thermus
thermophilus) 		PF00009
(GTP_EFTU)
PF04760
(IF2_N)
PF11987
(IF-2) 		5 ILE A 288
ALA A 264
VAL A 323
VAL A 279
GLY A 286
 None
 0.75A 3kw4A-3j4jA:
undetectable		 3kw4A-3j4jA:
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.
3l3b ES1 FAMILY PROTEIN

(Ehrlichia
chaffeensis) 		PF01965
(DJ-1_PfpI) 		6 SER A  18
GLU A  22
ILE A 138
VAL A 142
VAL A  98
GLY A  95
 None
 1.50A 3kw4A-3l3bA:
undetectable		 3kw4A-3l3bA:
19.57
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.
3n29 CARBOXYNORSPERMIDINE
DECARBOXYLASE

(Campylobacter
jejuni) 		PF00278
(Orn_DAP_Arg_deC) 		5 ILE A 353
SER A 265
ILE A 261
VAL A 250
GLY A 310
 None
 0.95A 3kw4A-3n29A:
undetectable		 3kw4A-3n29A:
21.05
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.
3nbe RICIN B-LIKE LECTIN

(Clitocybe
nebularis) 		PF14200
(RicinB_lectin_2) 		5 ILE A  19
ILE A  95
SER A  94
VAL A  71
VAL A  93
 None
 0.88A 3kw4A-3nbeA:
undetectable		 3kw4A-3nbeA:
16.14
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.
3org CMCLC

(Cyanidioschyzon
merolae) 		PF00654
(Voltage_CLC) 		5 ILE A 421
ILE A 436
ILE A 338
VAL A 341
GLY A 334
 None
 0.90A 3kw4A-3orgA:
undetectable		 3kw4A-3orgA:
23.10
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.
3qef BETA-XYLOSIDASE/ALPH
A-L-ARABINFURANOSIDA
SE, GLY43N

(Cellvibrio
japonicus) 		PF04616
(Glyco_hydro_43) 		5 ILE A 217
ILE A 246
SER A 245
PHE A 182
GLY A 248
 None
 0.84A 3kw4A-3qefA:
undetectable		 3kw4A-3qefA:
20.46
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3tk3 CYTOCHROME P450 2B4

(Oryctolagus
cuniculus) 		PF00067
(p450) 		9 ILE A 114
ILE A 209
PHE A 297
ALA A 298
THR A 302
ILE A 363
VAL A 367
VAL A 477
GLY A 478
 HEM  A 500 (-4.0A)
None
CPZ  A 501 (-4.3A)
CPZ  A 501 (-3.5A)
CPZ  A 501 ( 3.7A)
HEM  A 500 ( 3.9A)
HEM  A 500 ( 4.3A)
None
None
 0.64A 3kw4A-3tk3A:
60.2		 3kw4A-3tk3A:
99.79
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3tk3 CYTOCHROME P450 2B4

(Oryctolagus
cuniculus) 		PF00067
(p450) 		9 ILE A 114
ILE A 209
SER A 210
PHE A 297
ALA A 298
THR A 302
VAL A 367
VAL A 477
GLY A 478
 HEM  A 500 (-4.0A)
None
None
CPZ  A 501 (-4.3A)
CPZ  A 501 (-3.5A)
CPZ  A 501 ( 3.7A)
HEM  A 500 ( 4.3A)
None
None
 0.72A 3kw4A-3tk3A:
60.2		 3kw4A-3tk3A:
99.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3u7j RIBOSE-5-PHOSPHATE
ISOMERASE A

(Burkholderia
thailandensis) 		PF06026
(Rib_5-P_isom_A) 		5 ILE A 124
ILE A  32
PHE A  43
ALA A  40
THR A  64
 None
 0.97A 3kw4A-3u7jA:
undetectable		 3kw4A-3u7jA:
19.40
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.
3uhl PROTEASE

(Human
immunodeficiency
virus 1) 		PF00077
(RVP) 		5 THR A  89
ILE A  64
VAL A  15
VAL A  62
GLY A  73
 None
 0.91A 3kw4A-3uhlA:
undetectable		 3kw4A-3uhlA:
13.03
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.
3w1e FLAGELLA BASAL-BODY
PROTEIN

(Vibrio
alginolyticus) 		PF16538
(FlgT_C)
PF16539
(FlgT_M)
PF16548
(FlgT_N) 		5 ILE A 101
SER A 143
THR A 147
VAL A 144
GLY A 145
 None
 0.90A 3kw4A-3w1eA:
undetectable		 3kw4A-3w1eA:
24.17
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.
3wad GLYCOSYLTRANSFERASE

(Streptomyces
halstedii) 		PF06722
(DUF1205) 		5 ILE A 338
ILE A 330
PHE A 353
ALA A 359
GLY A 333
 None
 0.87A 3kw4A-3wadA:
undetectable		 3kw4A-3wadA:
21.56
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.
3wd8 TYPE III POLYKETIDE
SYNTHASE QUINOLONE
SYNTHASE

(Citrus x
microcarpa) 		PF00195
(Chal_sti_synt_N)
PF02797
(Chal_sti_synt_C) 		5 ILE A 309
SER A 246
ILE A 254
VAL A 271
GLY A 376
 None
 0.91A 3kw4A-3wd8A:
undetectable		 3kw4A-3wd8A:
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.
3x1l CMR6

(Archaeoglobus
fulgidus) 		PF03787
(RAMPs) 		5 ILE H 162
SER H 223
ALA H 209
VAL H 224
GLY H 225
 None
 0.84A 3kw4A-3x1lH:
undetectable		 3kw4A-3x1lH:
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.
3zgj 4-HYDROXYPHENYLPYRUV
IC ACID DIOXYGENASE

(Streptomyces
coelicolor) 		PF00903
(Glyoxalase)
PF14696
(Glyoxalase_5) 		6 ILE A  19
ILE A 141
ALA A  22
VAL A 182
VAL A 184
GLY A 258
 None
 1.38A 3kw4A-3zgjA:
undetectable		 3kw4A-3zgjA:
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.
3zth STU0660

(Streptococcus
thermophilus) 		PF16813
(Cas_St_Csn2) 		5 ILE A 246
SER A 251
ILE A 256
VAL A  24
VAL A 254
 None
 0.82A 3kw4A-3zthA:
undetectable		 3kw4A-3zthA:
22.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3zu0 NAD NUCLEOTIDASE

(Haemophilus
influenzae) 		PF00149
(Metallophos)
PF02872
(5_nucleotid_C) 		5 ILE A 415
ILE A 385
PHE A 414
VAL A 445
GLY A 383
 None
 0.93A 3kw4A-3zu0A:
undetectable		 3kw4A-3zu0A:
22.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4bev COPPER EFFLUX ATPASE

(Legionella
pneumophila) 		PF00122
(E1-E2_ATPase)
PF00702
(Hydrolase) 		5 SER A 404
ILE A 408
VAL A 654
VAL A 406
GLY A 401
 None
 0.85A 3kw4A-4bevA:
0.9		 3kw4A-4bevA:
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.
4bjp PENICILLIN BINDING
PROTEIN
TRANSPEPTIDASE
DOMAIN PROTEIN

(Escherichia
coli) 		PF00905
(Transpeptidase)
PF03717
(PBP_dimer) 		5 ILE A 532
SER A 546
ALA A 276
ILE A 553
VAL A 549
 None
None
None
None
GOL  A 625 ( 4.8A)
 0.84A 3kw4A-4bjpA:
undetectable		 3kw4A-4bjpA:
20.68
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.
4d2i HERA

(Sulfolobus
solfataricus) 		PF01935
(DUF87)
PF05872
(DUF853)
PF09378
(HAS-barrel) 		6 ILE A 146
ILE A 165
SER A 166
ILE A 174
VAL A 353
VAL A 172
 None
 1.24A 3kw4A-4d2iA:
undetectable		 3kw4A-4d2iA:
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.
4f2e CUPA

(Streptococcus
pneumoniae) 		PF13473
(Cupredoxin_1) 		5 ILE A  78
ILE A  54
PHE A 109
ILE A  99
VAL A  97
 None
 0.88A 3kw4A-4f2eA:
undetectable		 3kw4A-4f2eA:
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.
4hwi HEAT SHOCK COGNATE
71 KDA PROTEIN

(Homo sapiens) 		PF00012
(HSP70) 		5 ILE A  74
ALA A 157
ILE A 172
VAL A 146
VAL A 144
 None
 0.91A 3kw4A-4hwiA:
undetectable		 3kw4A-4hwiA:
20.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4iws PA0254

(Pseudomonas
aeruginosa) 		PF01977
(UbiD) 		5 ILE A  54
ILE A  37
ALA A  30
ILE A 308
VAL A  63
 None
 0.85A 3kw4A-4iwsA:
undetectable		 3kw4A-4iwsA:
23.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4jdu AEROTOLERANCE-RELATE
D MEMBRANE PROTEIN

(Bacteroides
fragilis) 		PF00092
(VWA) 		6 SER A 214
ALA A 206
GLU A 265
VAL A 195
VAL A 220
GLY A 266
 None
 1.35A 3kw4A-4jduA:
undetectable		 3kw4A-4jduA:
18.87
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.
4qaw XYN30D

(Paenibacillus
barcinonensis) 		PF03422
(CBM_6)
PF17189
(Glyco_hydro_30C) 		5 ILE A 326
SER A 370
ILE A 367
VAL A 350
VAL A 369
 None
 0.87A 3kw4A-4qawA:
undetectable		 3kw4A-4qawA:
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.
4ruh CYTOSOLIC
NON-SPECIFIC
DIPEPTIDASE

(Homo sapiens) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		5 SER A 471
ALA A 143
ILE A 154
VAL A 158
VAL A 156
 None
 0.94A 3kw4A-4ruhA:
undetectable		 3kw4A-4ruhA:
22.05
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.
4u0t ADC-7 BETA-LACTAMASE

(Acinetobacter
baumannii) 		PF00144
(Beta-lactamase) 		5 ILE A 357
ALA A 349
VAL A  30
VAL A  32
GLY A 332
 None
 0.96A 3kw4A-4u0tA:
undetectable		 3kw4A-4u0tA:
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.
4ubt ACETYL-COA
ACETYLTRANSFERASE
FADA5

(Mycobacterium
tuberculosis) 		PF00108
(Thiolase_N)
PF02803
(Thiolase_C) 		5 ILE A 196
SER A 354
ALA A  32
ILE A 120
GLY A 119
 None
 0.83A 3kw4A-4ubtA:
undetectable		 3kw4A-4ubtA:
22.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4v0n BARDET-BIEDL
SYNDROME 1 PROTEIN

(Chlamydomonas
reinhardtii) 		PF14779
(BBS1) 		5 ILE B 244
ALA B 265
ILE B 262
VAL B 260
GLY B 242
 None
 0.92A 3kw4A-4v0nB:
undetectable		 3kw4A-4v0nB:
22.48
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.
4xfd NH(3)-DEPENDENT
NAD(+) SYNTHETASE

(Pseudomonas
aeruginosa) 		PF02540
(NAD_synthase) 		5 ILE A  83
ALA A 155
VAL A 113
VAL A  85
GLY A  50
 None
 0.91A 3kw4A-4xfdA:
undetectable		 3kw4A-4xfdA:
19.84
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.
4zm6 N-ACETYL-BETA-D
GLUCOSAMINIDASE

(Rhizomucor
miehei) 		PF00583
(Acetyltransf_1)
PF00933
(Glyco_hydro_3) 		5 ILE A 250
SER A 244
VAL A 228
VAL A 230
GLY A 231
 None
 0.89A 3kw4A-4zm6A:
undetectable		 3kw4A-4zm6A:
21.35
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.
5cwo DESIGNED HELICAL
REPEAT PROTEIN

(synthetic
construct) 		no annotation 5 ILE A 104
ILE A  75
ALA A  67
GLU A  73
VAL A  19
 None
 0.93A 3kw4A-5cwoA:
undetectable		 3kw4A-5cwoA:
18.80
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5e0e CYTOCHROME P450
FAMILY 2 SUBFAMILY B

(Neotoma lepida) 		PF00067
(p450) 		7 ILE A 209
PHE A 297
ALA A 298
GLU A 301
THR A 302
ILE A 363
VAL A 367
 None
None
HEM  A 501 ( 3.1A)
None
CPZ  A 502 ( 4.0A)
HEM  A 501 (-4.1A)
HEM  A 501 ( 4.4A)
 0.88A 3kw4A-5e0eA:
54.6		 3kw4A-5e0eA:
79.87
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5e0e CYTOCHROME P450
FAMILY 2 SUBFAMILY B

(Neotoma lepida) 		PF00067
(p450) 		7 ILE A 209
SER A 210
PHE A 297
ALA A 298
GLU A 301
THR A 302
VAL A 367
 None
None
None
HEM  A 501 ( 3.1A)
None
CPZ  A 502 ( 4.0A)
HEM  A 501 ( 4.4A)
 1.03A 3kw4A-5e0eA:
54.6		 3kw4A-5e0eA:
79.87
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.
5ege ECTONUCLEOTIDE
PYROPHOSPHATASE/PHOS
PHODIESTERASE FAMILY
MEMBER 6

(Mus musculus) 		PF01663
(Phosphodiest) 		6 ILE A 236
SER A 412
PHE A 374
ILE A 383
VAL A 388
VAL A 410
 None
 1.40A 3kw4A-5egeA:
undetectable		 3kw4A-5egeA:
22.60
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.
5emi CELL WALL
HYDROLASE/AUTOLYSIN

(Nostoc
punctiforme) 		PF01520
(Amidase_3) 		5 ILE A 514
ILE A 547
ILE A 608
VAL A 543
GLY A 607
 None
 0.96A 3kw4A-5emiA:
undetectable		 3kw4A-5emiA:
19.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5emi CELL WALL
HYDROLASE/AUTOLYSIN

(Nostoc
punctiforme) 		PF01520
(Amidase_3) 		5 ILE A 547
ILE A 608
ILE A 514
VAL A 577
VAL A 512
 None
 0.90A 3kw4A-5emiA:
undetectable		 3kw4A-5emiA:
19.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5es9 LINEAR GRAMICIDIN
SYNTHETASE SUBUNIT A

(Brevibacillus
parabrevis) 		PF00501
(AMP-binding)
PF00550
(PP-binding)
PF00551
(Formyl_trans_N)
PF13193
(AMP-binding_C) 		5 ILE A 504
ILE A 515
GLU A 530
THR A 566
ILE A 533
 None
 0.85A 3kw4A-5es9A:
undetectable		 3kw4A-5es9A:
21.91
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.
5fpn HEAT SHOCK-RELATED
70 KDA PROTEIN 2

(Homo sapiens) 		PF00012
(HSP70) 		5 ILE A 214
ALA A 178
ILE A 199
VAL A 337
VAL A 197
 None
 0.92A 3kw4A-5fpnA:
undetectable		 3kw4A-5fpnA:
20.80
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.
5huo NICOTINATE-NUCLEOTID
E DIPHOSPHORYLASE
(CARBOXYLATING)

(Streptococcus
pyogenes) 		PF01729
(QRPTase_C)
PF02749
(QRPTase_N) 		6 ILE A 176
ALA A 208
GLU A 210
ILE A 220
VAL A 201
VAL A 217
 None
 1.12A 3kw4A-5huoA:
undetectable		 3kw4A-5huoA:
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.
5jnf LINEAR GRAMICIDIN
SYNTHASE SUBUNIT A

(Brevibacillus
parabrevis) 		no annotation 5 ILE C 504
ILE C 515
GLU C 530
THR C 566
ILE C 533
 None
 0.93A 3kw4A-5jnfC:
undetectable		 3kw4A-5jnfC:
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.
5n81 TYROCIDINE SYNTHASE
1

(Brevibacillus
parabrevis) 		no annotation 5 ILE A 346
ILE A 357
GLU A 372
THR A 409
ILE A 375
 None
 0.95A 3kw4A-5n81A:
undetectable		 3kw4A-5n81A:
11.48
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.
5uao TRYPTOPHANE-5-HALOGE
NASE

(Microbispora
sp. ATCC
PTA-5024) 		PF04820
(Trp_halogenase) 		6 SER A 347
THR A  39
ILE A 362
VAL A 366
VAL A 344
GLY A 345
 None
FAD  A 601 (-3.6A)
None
None
None
FAD  A 601 ( 3.7A)
 1.45A 3kw4A-5uaoA:
undetectable		 3kw4A-5uaoA:
20.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5vlq LOC100158544 PROTEIN

(Xenopus
tropicalis) 		PF03133
(TTL) 		5 ILE A 521
PHE A 143
ALA A 486
ILE A 402
VAL A 394
 None
 0.96A 3kw4A-5vlqA:
undetectable		 3kw4A-5vlqA:
21.19
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5wbg CYTOCHROME P450 2B6

(Homo sapiens) 		no annotation 7 ILE A 114
ILE A 209
SER A 210
ALA A 298
VAL A 367
VAL A 477
GLY A 478
 9ZJ  A 502 ( 3.6A)
9ZJ  A 502 ( 4.8A)
None
9ZJ  A 502 ( 3.5A)
9ZJ  A 502 ( 4.2A)
None
None
 0.77A 3kw4A-5wbgA:
58.4		 3kw4A-5wbgA:
86.25
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5wbg CYTOCHROME P450 2B6

(Homo sapiens) 		no annotation 7 ILE A 114
ILE A 209
SER A 210
THR A 302
VAL A 367
VAL A 477
GLY A 478
 9ZJ  A 502 ( 3.6A)
9ZJ  A 502 ( 4.8A)
None
9ZJ  A 502 ( 3.9A)
9ZJ  A 502 ( 4.2A)
None
None
 0.85A 3kw4A-5wbgA:
58.4		 3kw4A-5wbgA:
86.25
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.
5x2o TASTE RECEPTOR, TYPE
1, MEMBER 3

(Oryzias latipes) 		PF01094
(ANF_receptor) 		6 ILE B 297
ILE B 452
SER B 463
ILE B 474
VAL B 464
GLY B 465
 None
 0.95A 3kw4A-5x2oB:
0.2		 3kw4A-5x2oB:
21.36
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.
5xhh HCP1 FAMILY TYPE VI
SECRETION SYSTEM
EFFECTOR

(Salmonella
enterica) 		no annotation 5 ILE A  25
ILE A  79
ALA A  65
VAL A 125
VAL A 106
 None
 0.97A 3kw4A-5xhhA:
undetectable		 3kw4A-5xhhA:
9.93
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.
5xnc -

(-) 		no annotation 5 ILE A 280
ILE A 233
ILE A 241
VAL A 237
GLY A 238
 None
 0.94A 3kw4A-5xncA:
undetectable		 3kw4A-5xncA:
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.
6bni LYSINE--TRNA LIGASE

(Cryptosporidium
parvum) 		no annotation 6 ILE A 114
ILE A 118
SER A 100
ALA A 129
VAL A 154
GLY A 155
 None
 1.35A 3kw4A-6bniA:
undetectable		 3kw4A-6bniA:
13.03
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.
6d6q EXOSOME COMPLEX
EXONUCLEASE RRP44

(Homo sapiens) 		no annotation 5 ILE K  89
PHE K 123
GLU K 126
THR K  93
ILE K 149
 None
 0.96A 3kw4A-6d6qK:
undetectable		 3kw4A-6d6qK:
10.02
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.
6flz -

(-) 		no annotation 5 ILE A  78
ILE A  32
SER A  34
PHE A  97
GLY A 108
 None
 0.95A 3kw4A-6flzA:
undetectable		 3kw4A-6flzA:
undetectable