SIMILAR PATTERNS OF AMINO ACIDS FOR 1XDK_F_9CRF1600_2

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.
1aj8 CITRATE SYNTHASE

(Pyrococcus
furiosus) 		PF00285
(Citrate_synt) 		3 LEU A 317
PHE A 288
ARG A 273
 None
 0.74A 1xdkF-1aj8A:
0.0		 1xdkF-1aj8A:
22.68
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.
1bs0 PROTEIN
(8-AMINO-7-OXONANOAT
E SYNTHASE)

(Escherichia
coli) 		PF00155
(Aminotran_1_2) 		3 LEU A 276
PHE A 234
ARG A 101
 None
 0.82A 1xdkF-1bs0A:
undetectable		 1xdkF-1bs0A:
21.88
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.
1d6m DNA TOPOISOMERASE
III

(Escherichia
coli) 		PF01131
(Topoisom_bac)
PF01751
(Toprim) 		3 LEU A 205
PHE A 506
ARG A 489
 None
 0.82A 1xdkF-1d6mA:
undetectable		 1xdkF-1d6mA:
18.70
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1exx RETINOIC ACID
RECEPTOR GAMMA-2

(Homo sapiens) 		PF00104
(Hormone_recep) 		3 LEU A 233
PHE A 288
ARG A 396
 961  A 450 ( 4.0A)
961  A 450 (-4.6A)
None
 0.45A 1xdkF-1exxA:
37.3		 1xdkF-1exxA:
81.61
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.
1f3b GLUTATHIONE
S-TRANSFERASE YA
CHAIN

(Mus musculus) 		PF00043
(GST_C)
PF02798
(GST_N) 		3 LEU A 159
PHE A 135
ARG A  68
 None
 0.84A 1xdkF-1f3bA:
0.0		 1xdkF-1f3bA:
22.08
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.
1fiq XANTHINE OXIDASE

(Bos taurus) 		PF00111
(Fer2)
PF01799
(Fer2_2) 		3 LEU A   6
PHE A   8
ARG A  32
 None
 0.83A 1xdkF-1fiqA:
undetectable		 1xdkF-1fiqA:
20.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1gm5 RECG

(Thermotoga
maritima) 		PF00270
(DEAD)
PF00271
(Helicase_C)
PF17190
(RecG_N)
PF17191
(RecG_wedge) 		3 LEU A 671
PHE A 708
ARG A 680
 None
 0.85A 1xdkF-1gm5A:
undetectable		 1xdkF-1gm5A:
16.48
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.
1lcy HTRA2 SERINE
PROTEASE

(Homo sapiens) 		PF13180
(PDZ_2)
PF13365
(Trypsin_2) 		3 LEU A 133
PHE A 170
ARG A  74
 None
 0.85A 1xdkF-1lcyA:
undetectable		 1xdkF-1lcyA:
21.68
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.
1pjm IMPORTIN ALPHA-2
SUBUNIT

(Mus musculus) 		PF00514
(Arm)
PF16186
(Arm_3) 		3 LEU B 144
PHE B 124
ARG B 106
 None
 0.63A 1xdkF-1pjmB:
0.2		 1xdkF-1pjmB:
21.81
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.
1sk7 HYPOTHETICAL PROTEIN
PA-HO

(Pseudomonas
aeruginosa) 		PF01126
(Heme_oxygenase) 		3 LEU A 138
PHE A  45
ARG A 154
 None
 0.85A 1xdkF-1sk7A:
undetectable		 1xdkF-1sk7A:
20.38
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.
1taq TAQ DNA POLYMERASE

(Thermus
aquaticus) 		PF00476
(DNA_pol_A)
PF01367
(5_3_exonuc)
PF02739
(5_3_exonuc_N)
PF09281
(Taq-exonuc) 		3 LEU A 574
PHE A 564
ARG A 595
 None
 0.61A 1xdkF-1taqA:
undetectable		 1xdkF-1taqA:
15.75
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.
1v43 SUGAR-BINDING
TRANSPORT
ATP-BINDING PROTEIN

(Pyrococcus
horikoshii) 		PF00005
(ABC_tran)
PF08402
(TOBE_2) 		3 LEU A 260
PHE A 287
ARG A 310
 None
 0.69A 1xdkF-1v43A:
undetectable		 1xdkF-1v43A:
23.23
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.
1wyt GLYCINE
DEHYDROGENASE
SUBUNIT 2
(P-PROTEIN)

(Thermus
thermophilus) 		PF02347
(GDC-P) 		3 LEU B 325
PHE B 324
ARG B 335
 None
 0.85A 1xdkF-1wytB:
undetectable		 1xdkF-1wytB:
20.21
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1xap RETINOIC ACID
RECEPTOR BETA

(Homo sapiens) 		PF00104
(Hormone_recep) 		3 LEU A 224
PHE A 279
ARG A 387
 TTB  A   1 (-4.4A)
TTB  A   1 (-4.6A)
None
 0.21A 1xdkF-1xapA:
37.1		 1xdkF-1xapA:
92.57
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.
1zrt CYTOCHROME C1

(Rhodobacter
capsulatus) 		PF02167
(Cytochrom_C1) 		3 LEU D  23
PHE D 212
ARG D  46
 None
 0.85A 1xdkF-1zrtD:
undetectable		 1xdkF-1zrtD:
20.85
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.
2crp REGULATOR OF
G-PROTEIN SIGNALING
5

(Homo sapiens) 		PF00615
(RGS) 		3 LEU A  32
PHE A  42
ARG A 121
 None
 0.81A 1xdkF-2crpA:
undetectable		 1xdkF-2crpA:
20.27
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.
2dc1 L-ASPARTATE
DEHYDROGENASE

(Archaeoglobus
fulgidus) 		PF01958
(DUF108)
PF03447
(NAD_binding_3) 		3 LEU A  91
PHE A  85
ARG A 103
 None
 0.82A 1xdkF-2dc1A:
undetectable		 1xdkF-2dc1A:
21.63
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.
2hst EUKARYOTIC PEPTIDE
CHAIN RELEASE FACTOR
SUBUNIT 1

(Homo sapiens) 		PF03464
(eRF1_2) 		3 LEU A 212
PHE A 158
ARG A 203
 None
 0.86A 1xdkF-2hstA:
undetectable		 1xdkF-2hstA:
18.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2iqc FANCONI ANEMIA GROUP
F PROTEIN

(Homo sapiens) 		PF11107
(FANCF) 		3 LEU A 196
PHE A 201
ARG A 187
 None
 0.71A 1xdkF-2iqcA:
undetectable		 1xdkF-2iqcA:
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.
2iw0 CHITIN DEACETYLASE

(Colletotrichum
lindemuthianum) 		PF01522
(Polysacc_deac_1) 		3 LEU A 220
PHE A 188
ARG A 230
 None
 0.64A 1xdkF-2iw0A:
undetectable		 1xdkF-2iw0A:
19.68
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.
2iy4 NON-HEME
IRON-CONTAINING
FERRITIN

(Listeria
monocytogenes) 		PF00210
(Ferritin) 		3 LEU A 119
PHE A  12
ARG A 110
 None
 0.73A 1xdkF-2iy4A:
undetectable		 1xdkF-2iy4A:
22.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2kfu RV1827 PTHR 22

(Mycobacterium
tuberculosis) 		PF00498
(FHA) 		3 LEU A  58
PHE A 146
ARG A 123
 None
 0.78A 1xdkF-2kfuA:
undetectable		 1xdkF-2kfuA:
21.26
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.
2o26 KIT LIGAND
MAST/STEM CELL
GROWTH FACTOR
RECEPTOR

(Mus musculus) 		PF02404
(SCF)
no annotation 		3 LEU X 125
PHE X 201
ARG A 104
 None
 0.66A 1xdkF-2o26X:
undetectable		 1xdkF-2o26X:
22.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ohf GTP-BINDING PROTEIN
9

(Homo sapiens) 		PF01926
(MMR_HSR1)
PF06071
(YchF-GTPase_C) 		3 LEU A  88
PHE A 300
ARG A 317
 None
 0.85A 1xdkF-2ohfA:
undetectable		 1xdkF-2ohfA:
21.30
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.
2ok8 PUTATIVE
FERREDOXIN--NADP
REDUCTASE

(Plasmodium
falciparum) 		PF00175
(NAD_binding_1) 		3 LEU A  16
PHE A  46
ARG A  98
 None
 0.82A 1xdkF-2ok8A:
undetectable		 1xdkF-2ok8A:
17.21
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.
2p5x N-ACETYLSEROTONIN
O-METHYLTRANSFERASE-
LIKE PROTEIN

(Homo sapiens) 		PF02545
(Maf) 		3 LEU A  33
PHE A  35
ARG A  23
 None
 0.82A 1xdkF-2p5xA:
undetectable		 1xdkF-2p5xA:
20.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2pok PEPTIDASE,
M20/M25/M40 FAMILY

(Streptococcus
pneumoniae) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		3 LEU A 296
PHE A 295
ARG A 334
 None
 0.82A 1xdkF-2pokA:
undetectable		 1xdkF-2pokA:
20.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2qdj RETINOBLASTOMA-ASSOC
IATED PROTEIN

(Homo sapiens) 		PF11934
(DUF3452) 		3 LEU A  64
PHE A 115
ARG A  73
 None
 0.63A 1xdkF-2qdjA:
2.5		 1xdkF-2qdjA:
23.81
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.
2qv2 INOSITOL
POLYPHOSPHATE
5-PHOSPHATASE OCRL-1

(Homo sapiens) 		PF00620
(RhoGAP) 		3 LEU A 310
PHE A 331
ARG A 274
 LEU  A 310 ( 0.6A)
PHE  A 331 ( 1.3A)
ARG  A 274 ( 0.6A)
 0.72A 1xdkF-2qv2A:
undetectable		 1xdkF-2qv2A:
21.29
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.
2rch CYTOCHROME P450 74A

(Arabidopsis
thaliana) 		PF00067
(p450) 		3 LEU A 221
PHE A 220
ARG A 179
 None
 0.84A 1xdkF-2rchA:
undetectable		 1xdkF-2rchA:
22.57
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.
2vjw GAF FAMILY PROTEIN

(Mycolicibacterium
smegmatis) 		PF01590
(GAF) 		3 LEU A 247
PHE A 355
ARG A 238
 None
 0.80A 1xdkF-2vjwA:
undetectable		 1xdkF-2vjwA:
19.32
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.
2y3a PHOSPHATIDYLINOSITOL
-4,5-BISPHOSPHATE
3-KINASE CATALYTIC
SUBUNIT BETA ISOFORM

(Mus musculus) 		PF00454
(PI3_PI4_kinase)
PF00613
(PI3Ka)
PF00792
(PI3K_C2)
PF00794
(PI3K_rbd)
PF02192
(PI3K_p85B) 		3 LEU A 242
PHE A 275
ARG A 662
 None
 0.79A 1xdkF-2y3aA:
undetectable		 1xdkF-2y3aA:
14.82
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.
2y6i COLLAGENASE

(Hathewaya
histolytica) 		PF01752
(Peptidase_M9)
PF08453
(Peptidase_M9_N) 		3 LEU A 617
PHE A 625
ARG A 573
 None
 0.76A 1xdkF-2y6iA:
undetectable		 1xdkF-2y6iA:
16.62
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.
2yik ENDOGLUCANASE

(Ruminiclostridium
thermocellum) 		PF00759
(Glyco_hydro_9) 		3 LEU A 100
PHE A 170
ARG A  78
 None
 0.63A 1xdkF-2yikA:
undetectable		 1xdkF-2yikA:
16.12
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.
2yuj UBIQUITIN FUSION
DEGRADATION 1-LIKE

(Homo sapiens) 		PF03152
(UFD1) 		3 LEU A  50
PHE A  82
ARG A  15
 None
 0.71A 1xdkF-2yujA:
undetectable		 1xdkF-2yujA:
19.80
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.
3boh CADMIUM-SPECIFIC
CARBONIC ANHYDRASE

(Conticribra
weissflogii) 		no annotation 3 LEU A  85
PHE A 136
ARG A  80
 None
 0.80A 1xdkF-3bohA:
undetectable		 1xdkF-3bohA:
20.95
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.
3bpo INTERLEUKIN-13
RECEPTOR ALPHA-1
CHAIN

(Homo sapiens) 		PF09240
(IL6Ra-bind) 		3 LEU C 258
PHE C 253
ARG C 225
 LEU  C 258 ( 0.5A)
PHE  C 253 ( 1.3A)
ARG  C 225 ( 0.6A)
 0.76A 1xdkF-3bpoC:
undetectable		 1xdkF-3bpoC:
19.94
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.
3ddd PUTATIVE
ACETYLTRANSFERASE

(Pyrococcus
horikoshii) 		PF00583
(Acetyltransf_1) 		3 LEU A 114
PHE A  89
ARG A 246
 COA  A 300 (-4.1A)
None
None
 0.68A 1xdkF-3dddA:
undetectable		 1xdkF-3dddA:
19.50
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.
3hoc FILAMIN-A

(Homo sapiens) 		PF00307
(CH) 		3 LEU A 201
PHE A 264
ARG A 226
 None
 0.70A 1xdkF-3hocA:
undetectable		 1xdkF-3hocA:
23.35
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.
3j5y EUKARYOTIC PEPTIDE
CHAIN RELEASE FACTOR
SUBUNIT 1

(Homo sapiens) 		PF03463
(eRF1_1)
PF03464
(eRF1_2)
PF03465
(eRF1_3) 		3 LEU A 212
PHE A 158
ARG A 203
 None
 0.77A 1xdkF-3j5yA:
undetectable		 1xdkF-3j5yA:
21.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3jcm PRE-MRNA-SPLICING
FACTOR 6

(Saccharomyces
cerevisiae) 		PF06424
(PRP1_N) 		3 LEU G 780
PHE G 781
ARG G 800
 None
 0.76A 1xdkF-3jcmG:
undetectable		 1xdkF-3jcmG:
16.22
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.
3ksm ABC-TYPE SUGAR
TRANSPORT SYSTEM,
PERIPLASMIC
COMPONENT

(Hahella
chejuensis) 		PF13407
(Peripla_BP_4) 		3 LEU A 170
PHE A 187
ARG A 166
 None
 0.82A 1xdkF-3ksmA:
undetectable		 1xdkF-3ksmA:
23.78
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.
3m8f PUTATIVE DNA-BINDING
PROTEIN

(Bacillus
thuringiensis) 		no annotation 3 LEU A  83
PHE A  31
ARG A  74
 None
 0.85A 1xdkF-3m8fA:
undetectable		 1xdkF-3m8fA:
20.00
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.
3nvy XANTHINE
DEHYDROGENASE/OXIDAS
E

(Bos taurus) 		PF00111
(Fer2)
PF01799
(Fer2_2) 		3 LEU A   6
PHE A   8
ARG A  32
 None
 0.85A 1xdkF-3nvyA:
undetectable		 1xdkF-3nvyA:
19.47
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.
3p8c NCK-ASSOCIATED
PROTEIN 1

(Homo sapiens) 		PF09735
(Nckap1) 		3 LEU B  28
PHE B 296
ARG B 588
 None
 0.83A 1xdkF-3p8cB:
3.5		 1xdkF-3p8cB:
15.33
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.
3qwm IQ MOTIF AND SEC7
DOMAIN-CONTAINING
PROTEIN 1

(Homo sapiens) 		PF16453
(IQ_SEC7_PH) 		3 LEU A 745
PHE A 828
ARG A 789
 None
 0.71A 1xdkF-3qwmA:
undetectable		 1xdkF-3qwmA:
19.67
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.
3srz TOXIN A

(Clostridioides
difficile) 		PF12918
(TcdB_N)
PF12919
(TcdA_TcdB) 		3 LEU A 446
PHE A 445
ARG A 261
 None
 0.70A 1xdkF-3srzA:
undetectable		 1xdkF-3srzA:
20.75
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.
3uk8 CADMIUM-SPECIFIC
CARBONIC ANHYDRASE

(Conticribra
weissflogii) 		no annotation 3 LEU A 505
PHE A 556
ARG A 500
 None
 0.86A 1xdkF-3uk8A:
undetectable		 1xdkF-3uk8A:
21.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3voo FATTY ACID
ALPHA-HYDROXYLASE

(Sphingomonas
paucimobilis) 		PF00067
(p450) 		3 LEU A  31
PHE A  36
ARG A  22
 None
 0.74A 1xdkF-3vooA:
undetectable		 1xdkF-3vooA:
19.46
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.
3zrh UBIQUITIN
THIOESTERASE ZRANB1

(Homo sapiens) 		PF02338
(OTU) 		3 LEU A 579
PHE A 586
ARG A 557
 None
 0.85A 1xdkF-3zrhA:
undetectable		 1xdkF-3zrhA:
20.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4a2v RETINOIC ACID
INDUCIBLE PROTEIN I

(Anas
platyrhynchos) 		PF11648
(RIG-I_C-RD) 		3 LEU A 810
PHE A 895
ARG A 867
 None
 0.59A 1xdkF-4a2vA:
undetectable		 1xdkF-4a2vA:
16.29
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.
4apl APICAL MEMBRANE
ANTIGEN 1

(Neospora
caninum) 		PF02430
(AMA-1) 		3 LEU A 223
PHE A 153
ARG A 105
 None
 0.80A 1xdkF-4aplA:
undetectable		 1xdkF-4aplA:
19.30
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.
4are COLLAGENASE G

(Hathewaya
histolytica) 		PF01752
(Peptidase_M9)
PF08453
(Peptidase_M9_N) 		3 LEU A 617
PHE A 625
ARG A 573
 None
 0.74A 1xdkF-4areA:
undetectable		 1xdkF-4areA:
17.19
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.
4bxs VENOM PROTHROMBIN
ACTIVATOR
PSEUTARIN-C
NON-CATALYTIC
SUBUNIT

(Pseudonaja
textilis) 		PF00754
(F5_F8_type_C)
PF07732
(Cu-oxidase_3) 		3 LEU V 614
PHE V 604
ARG V 649
 None
 0.83A 1xdkF-4bxsV:
undetectable		 1xdkF-4bxsV:
11.78
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.
4cmr GLYCOSYL
HYDROLASE/DEACETYLAS
E FAMILY PROTEIN

(Pyrococcus sp.
ST04) 		no annotation 3 LEU A 396
PHE A 395
ARG A 405
 None
 0.83A 1xdkF-4cmrA:
undetectable		 1xdkF-4cmrA:
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.
4d0k PAB-DEPENDENT
POLY(A)-SPECIFIC
RIBONUCLEASE SUBUNIT
PAN3-LIKE PROTEIN

(Chaetomium
thermophilum) 		no annotation 3 LEU B 542
PHE B 488
ARG B 453
 None
 0.80A 1xdkF-4d0kB:
undetectable		 1xdkF-4d0kB:
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.
4dwn BCL10-INTERACTING
CARD PROTEIN

(Homo sapiens) 		no annotation 3 LEU A  10
PHE A  80
ARG A  94
 None
None
SO4  A 102 (-2.5A)
 0.84A 1xdkF-4dwnA:
undetectable		 1xdkF-4dwnA:
16.56
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.
4epp POLY(ADP-RIBOSE)
GLYCOHYDROLASE

(Tetrahymena
thermophila) 		PF05028
(PARG_cat) 		3 LEU A 266
PHE A 259
ARG A 195
 None
 0.71A 1xdkF-4eppA:
undetectable		 1xdkF-4eppA:
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.
4hss PUTATIVE FIMBRIAL
SUBUNIT

(Corynebacterium
diphtheriae) 		no annotation 3 LEU A 282
PHE A 284
ARG A 300
 None
 0.82A 1xdkF-4hssA:
undetectable		 1xdkF-4hssA:
21.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4i2w PROTEIN UNC-45

(Caenorhabditis
elegans) 		PF11701
(UNC45-central) 		3 LEU A 322
PHE A 337
ARG A 311
 None
 0.69A 1xdkF-4i2wA:
undetectable		 1xdkF-4i2wA:
14.33
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.
4i8v CYTOCHROME P450 1A1

(Homo sapiens) 		PF00067
(p450) 		3 LEU A 177
PHE A 184
ARG A 477
 None
 0.76A 1xdkF-4i8vA:
undetectable		 1xdkF-4i8vA:
20.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4jpk GERMLINE-TARGETING
HIV-1 GP120
ENGINEERED OUTER
DOMAIN, EOD-GT6

(Human
immunodeficiency
virus 1) 		PF00516
(GP120) 		3 LEU A  24
PHE A  38
ARG A  81
 None
 0.66A 1xdkF-4jpkA:
undetectable		 1xdkF-4jpkA:
19.41
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.
4kk7 ESX-1 SECRETION
SYSTEM PROTEIN ECCB1

(Mycobacterium
tuberculosis) 		PF05108
(T7SS_ESX1_EccB) 		3 LEU A 262
PHE A 268
ARG A 322
 None
 0.83A 1xdkF-4kk7A:
undetectable		 1xdkF-4kk7A:
20.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4kny KDP OPERON
TRANSCRIPTIONAL
REGULATORY PROTEIN
KDPE

(Escherichia
coli) 		PF00072
(Response_reg)
PF00486
(Trans_reg_C) 		3 LEU A  51
PHE A  63
ARG A  44
 None
 0.81A 1xdkF-4knyA:
undetectable		 1xdkF-4knyA:
21.20
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.
4m2g L-ARGININE
BETA-HYDROXYLASE

(Streptomyces
lavendulae) 		PF02668
(TauD) 		3 LEU A  60
PHE A  59
ARG A  68
 None
 0.85A 1xdkF-4m2gA:
undetectable		 1xdkF-4m2gA:
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.
4mbo SERINE-RICH REPEAT
ADHESION
GLYCOPROTEIN (SRR1)

(Streptococcus
agalactiae) 		PF10425
(SdrG_C_C) 		3 LEU A 542
PHE A 562
ARG A 485
 None
 0.79A 1xdkF-4mboA:
undetectable		 1xdkF-4mboA:
21.17
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.
4n9x PUTATIVE
MONOOXYGENASE

(Pectobacterium
atrosepticum) 		PF01494
(FAD_binding_3) 		3 LEU A 257
PHE A 214
ARG A 247
 None
 0.83A 1xdkF-4n9xA:
undetectable		 1xdkF-4n9xA:
22.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4nmn REPLICATIVE DNA
HELICASE

(Aquifex
aeolicus) 		PF00772
(DnaB)
PF03796
(DnaB_C) 		3 LEU A 426
PHE A 186
ARG A 246
 None
None
ADP  A1001 (-2.6A)
 0.75A 1xdkF-4nmnA:
undetectable		 1xdkF-4nmnA:
23.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4oy7 PUTATIVE SECRETED
CELLULOSE BINDING
PROTEIN

(Streptomyces
coelicolor) 		PF03067
(LPMO_10) 		3 LEU A 168
PHE A 207
ARG A  92
 None
 0.81A 1xdkF-4oy7A:
undetectable		 1xdkF-4oy7A:
20.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4r4z PNGF-II

(Elizabethkingia
meningoseptica) 		PF09112
(N-glycanase_N)
PF09113
(N-glycanase_C) 		3 LEU A 483
PHE A 437
ARG A 247
 None
 0.80A 1xdkF-4r4zA:
undetectable		 1xdkF-4r4zA:
20.58
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.
4rew 5'-AMP-ACTIVATED
PROTEIN KINASE
CATALYTIC SUBUNIT
ALPHA-1

(Homo sapiens) 		PF00069
(Pkinase)
PF16579
(AdenylateSensor) 		3 LEU A  70
PHE A 160
ARG A 134
 None
 0.83A 1xdkF-4rewA:
undetectable		 1xdkF-4rewA:
19.75
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.
4um8 INTEGRIN ALPHA-V

(Homo sapiens) 		PF01839
(FG-GAP)
PF08441
(Integrin_alpha2) 		3 LEU A 538
PHE A 513
ARG A 588
 None
 0.78A 1xdkF-4um8A:
undetectable		 1xdkF-4um8A:
18.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ys8 2-C-METHYL-D-ERYTHRI
TOL 4-PHOSPHATE
CYTIDYLYLTRANSFERASE

(Burkholderia
thailandensis) 		PF01128
(IspD) 		3 LEU A  39
PHE A  67
ARG A  27
 None
 0.86A 1xdkF-4ys8A:
undetectable		 1xdkF-4ys8A:
22.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5a3f DYNAMIN 3

(Homo sapiens) 		PF00169
(PH)
PF00350
(Dynamin_N)
PF01031
(Dynamin_M)
PF02212
(GED) 		3 LEU A 617
PHE A 372
ARG A 569
 None
 0.63A 1xdkF-5a3fA:
undetectable		 1xdkF-5a3fA:
17.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5a53 RIBOSOME BIOGENESIS
PROTEIN RPF2

(Saccharomyces
cerevisiae) 		PF04427
(Brix) 		3 LEU C 160
PHE C 102
ARG C 202
 None
 0.85A 1xdkF-5a53C:
undetectable		 1xdkF-5a53C:
23.42
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.
5cy1 TRANSPOSON TN3
RESOLVASE

(Escherichia
coli) 		PF00239
(Resolvase)
PF02796
(HTH_7) 		3 LEU A  66
PHE A  92
ARG A  45
 None
 0.71A 1xdkF-5cy1A:
undetectable		 1xdkF-5cy1A:
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.
5euf PROTEASE

(Helicobacter
pylori) 		PF00675
(Peptidase_M16)
PF05193
(Peptidase_M16_C) 		3 LEU A 133
PHE A  96
ARG A 117
 None
 0.85A 1xdkF-5eufA:
undetectable		 1xdkF-5eufA:
20.59
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.
5fq6 SUSC/RAGA FAMILY
TONB-LINKED OUTER
MEMBRANE PROTEIN

(Bacteroides
thetaiotaomicron) 		PF00593
(TonB_dep_Rec)
PF07715
(Plug) 		3 LEU B 704
PHE B 724
ARG B 700
 None
 0.85A 1xdkF-5fq6B:
undetectable		 1xdkF-5fq6B:
15.27
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.
5fyg CYTOCHROME P450

(Marinobacter
hydrocarbonoclasticus) 		PF00067
(p450) 		3 LEU A 294
PHE A 301
ARG A 270
 None
 0.45A 1xdkF-5fygA:
undetectable		 1xdkF-5fygA:
19.47
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.
5h2r PHOSPHODIESTERASE

(Trypanosoma
brucei) 		no annotation 3 LEU A 625
PHE A 671
ARG A 634
 None
 0.81A 1xdkF-5h2rA:
undetectable		 1xdkF-5h2rA:
22.03
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.
5hos CELLULASE

(Xanthomonas
citri) 		PF00150
(Cellulase) 		3 LEU A 248
PHE A 251
ARG A 318
 None
 0.86A 1xdkF-5hosA:
undetectable		 1xdkF-5hosA:
19.34
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.
5i6i ACETYL-COA
CARBOXYLASE-LIKE
PROTEIN,ACETYL-COA
CARBOXYLASE-LIKE
PROTEIN,ACETYL-COA
CARBOXYLASE-LIKE
PROTEIN

(Chaetomium
thermophilum) 		PF01039
(Carboxyl_trans)
PF08326
(ACC_central) 		3 LEU A1988
PHE A1980
ARG A1885
 None
 0.84A 1xdkF-5i6iA:
undetectable		 1xdkF-5i6iA:
9.79
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.
5iz5 CYTOSOLIC
PHOSPHOLIPASE A2
DELTA

(Homo sapiens) 		no annotation 3 LEU B 606
PHE B 490
ARG B 601
 None
None
SO4  B 909 (-3.8A)
 0.81A 1xdkF-5iz5B:
undetectable		 1xdkF-5iz5B:
17.10
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.
5j1s TORSIN-1A-INTERACTIN
G PROTEIN 2

(Homo sapiens) 		PF05609
(LAP1C) 		3 LEU B 453
PHE B 280
ARG B 449
 None
 0.70A 1xdkF-5j1sB:
undetectable		 1xdkF-5j1sB:
22.96
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.
5jze RNA-DEPENDENT RNA
POLYMERASE

(Thiafora
orthonairovirus) 		PF02338
(OTU) 		3 LEU A 158
PHE A  32
ARG A 140
 None
 0.83A 1xdkF-5jzeA:
undetectable		 1xdkF-5jzeA:
17.67
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5k13 RETINOIC ACID
RECEPTOR ALPHA

(Homo sapiens) 		PF00104
(Hormone_recep) 		3 LEU A 231
PHE A 286
ARG A 394
 6Q7  A 501 ( 4.3A)
6Q7  A 501 (-4.7A)
None
 0.40A 1xdkF-5k13A:
35.3		 1xdkF-5k13A:
78.18
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.
5ljm SPERMATOGENESIS-ASSO
CIATED PROTEIN 2

(Homo sapiens) 		no annotation 3 LEU A  52
PHE A  11
ARG A  43
 None
 0.73A 1xdkF-5ljmA:
undetectable		 1xdkF-5ljmA:
24.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5omc REPLICATION FACTOR A
PROTEIN 1

(Saccharomyces
cerevisiae) 		no annotation 3 LEU A 120
PHE A  11
ARG A  76
 None
 0.73A 1xdkF-5omcA:
undetectable		 1xdkF-5omcA:
16.07
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5uan RETINOIC ACID
RECEPTOR BETA

(Homo sapiens) 		no annotation 3 LEU B 224
PHE B 279
ARG B 387
 REA  B 503 ( 4.0A)
REA  B 503 (-4.4A)
None
 0.50A 1xdkF-5uanB:
38.3		 1xdkF-5uanB:
98.68
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.
5ver KYNURENINE--OXOGLUTA
RATE TRANSAMINASE 3

(Mus musculus) 		no annotation 3 LEU A 357
PHE A 447
ARG A 430
 None
None
EPE  A 702 (-3.1A)
 0.70A 1xdkF-5verA:
undetectable		 1xdkF-5verA:
21.39
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.
5vnc GLYCOGEN [STARCH]
SYNTHASE ISOFORM 2

(Saccharomyces
cerevisiae) 		no annotation 3 LEU A 176
PHE A 190
ARG A 230
 None
 0.50A 1xdkF-5vncA:
undetectable		 1xdkF-5vncA:
12.21
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.
5zk4 DISA PROTEIN

(Sorangium
cellulosum) 		no annotation 3 LEU C  49
PHE C  39
ARG C  84
 None
 0.78A 1xdkF-5zk4C:
undetectable		 1xdkF-5zk4C:
14.19
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.
6am0 KLLA0F23980P

(Kluyveromyces
lactis) 		no annotation 3 LEU A 114
PHE A 110
ARG A 230
 None
 0.63A 1xdkF-6am0A:
undetectable		 1xdkF-6am0A:
14.29
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.
6ao8 ARGININE--TRNA
LIGASE

(Neisseria
gonorrhoeae) 		PF00750
(tRNA-synt_1d)
PF03485
(Arg_tRNA_synt_N)
PF05746
(DALR_1) 		3 LEU A 173
PHE A 230
ARG A 193
 None
 0.85A 1xdkF-6ao8A:
undetectable		 1xdkF-6ao8A:
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.
6b12 TNI2

(Pseudomonas
protegens) 		no annotation 3 LEU B  55
PHE B 111
ARG B  92
 None
 0.72A 1xdkF-6b12B:
undetectable		 1xdkF-6b12B:
14.63
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.
6bfn INTERLEUKIN-1
RECEPTOR-ASSOCIATED
KINASE 1

(Homo sapiens) 		no annotation 3 LEU A 263
PHE A 359
ARG A 324
 None
 0.81A 1xdkF-6bfnA:
undetectable		 1xdkF-6bfnA:
12.54
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.
6f0k FE-S-CLUSTER-CONTAIN
ING HYDROGENASE

(Rhodothermus
marinus) 		no annotation 3 LEU B 357
PHE B 255
ARG B 285
 None
 0.69A 1xdkF-6f0kB:
undetectable		 1xdkF-6f0kB:
15.02
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.
6fuy VINCULIN

(Homo sapiens) 		no annotation 3 LEU A 818
PHE A 817
ARG A 759
 None
 0.83A 1xdkF-6fuyA:
undetectable		 1xdkF-6fuyA:
12.50
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.
6fx0 RETINOIC ACID
RECEPTOR GAMMA

(Homo sapiens) 		no annotation 3 LEU A 233
PHE A 288
ARG A 396
 E9T  A 501 ( 4.3A)
E9T  A 501 (-4.7A)
None
 0.34A 1xdkF-6fx0A:
37.2		 1xdkF-6fx0A:
15.51