SIMILAR PATTERNS OF AMINO ACIDS FOR 1DF7_A_MTXA501_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.
1cc1 HYDROGENASE (LARGE
SUBUNIT)

(Desulfomicrobium
baculatum) 		PF00374
(NiFeSe_Hases) 		3 TRP L 386
ARG L 377
THR L 385
 None
 0.90A 1df7A-1cc1L:
undetectable		 1df7A-1cc1L:
15.57
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.
1fep FERRIC ENTEROBACTIN
RECEPTOR

(Escherichia
coli) 		PF00593
(TonB_dep_Rec)
PF07715
(Plug) 		3 TRP A 627
ARG A 682
THR A 626
 None
 0.98A 1df7A-1fepA:
undetectable		 1df7A-1fepA:
13.17
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.
1fiz BETA-ACROSIN HEAVY
CHAIN

(Sus scrofa) 		PF00089
(Trypsin) 		3 TRP A 232
ARG A 201
THR A 231
 None
 1.01A 1df7A-1fizA:
undetectable		 1df7A-1fizA:
22.62
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.
1h4p GLUCAN
1,3-BETA-GLUCOSIDASE
I/II

(Saccharomyces
cerevisiae) 		PF00150
(Cellulase) 		3 TRP A 419
ARG A 391
THR A 340
 None
 1.00A 1df7A-1h4pA:
undetectable		 1df7A-1h4pA:
19.64
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.
1itz TRANSKETOLASE

(Zea mays) 		PF00456
(Transketolase_N)
PF02779
(Transket_pyr)
PF02780
(Transketolase_C) 		3 TRP A 293
ARG A 104
THR A 297
 None
 0.93A 1df7A-1itzA:
0.3		 1df7A-1itzA:
13.77
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.
1js1 TRANSCARBAMYLASE

(Bacteroides
fragilis) 		PF00185
(OTCace)
PF02729
(OTCace_N) 		3 TRP X 256
ARG X 178
THR X 257
 None
 0.91A 1df7A-1js1X:
0.0		 1df7A-1js1X:
18.43
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.
1m3d TYPE IV COLLAGEN
NONCOLLAGENOUS
DOMAIN- ALPHA2

(Bos taurus) 		PF01413
(C4) 		3 TRP C  81
ARG C  75
THR C  58
 None
 0.97A 1df7A-1m3dC:
undetectable		 1df7A-1m3dC:
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.
1m41 FMNH2-DEPENDENT
ALKANESULFONATE
MONOOXYGENASE

(Escherichia
coli) 		PF00296
(Bac_luciferase) 		3 TRP A 196
ARG A 314
THR A 195
 None
 0.99A 1df7A-1m41A:
undetectable		 1df7A-1m41A:
18.32
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.
1m54 CYSTATHIONINE
BETA-SYNTHASE

(Homo sapiens) 		PF00291
(PALP) 		3 TRP A 390
ARG A 182
THR A 383
 None
 0.85A 1df7A-1m54A:
0.0		 1df7A-1m54A:
19.31
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.
1mu2 HIV-2 RT

(Human
immunodeficiency
virus 2) 		PF00078
(RVT_1)
PF06815
(RVT_connect)
PF06817
(RVT_thumb) 		3 TRP B 239
ARG B 193
THR B 237
 None
 1.01A 1df7A-1mu2B:
undetectable		 1df7A-1mu2B:
17.14
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.
1n60 CARBON MONOXIDE
DEHYDROGENASE LARGE
CHAIN
CARBON MONOXIDE
DEHYDROGENASE SMALL
CHAIN

(Oligotropha
carboxidovorans) 		PF00111
(Fer2)
PF01315
(Ald_Xan_dh_C)
PF01799
(Fer2_2)
PF02738
(Ald_Xan_dh_C2) 		3 TRP B 742
ARG A 112
THR A 140
 None
None
FES  A4907 ( 4.8A)
 0.94A 1df7A-1n60B:
undetectable		 1df7A-1n60B:
12.07
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.
1qce PROTEIN (GP41)

(Simian
immunodeficiency
virus) 		PF00517
(GP41) 		3 TRP A  58
ARG A  63
THR A  68
 None
 0.98A 1df7A-1qceA:
undetectable		 1df7A-1qceA:
21.08
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.
1quu HUMAN SKELETAL
MUSCLE ALPHA-ACTININ
2

(Homo sapiens) 		PF00435
(Spectrin) 		3 TRP A  29
ARG A  20
THR A  28
 None
 0.87A 1df7A-1quuA:
undetectable		 1df7A-1quuA:
18.92
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.
1r76 PECTATE LYASE

(Niveispirillum
irakense) 		PF09492
(Pec_lyase) 		3 TRP A 376
ARG A 289
THR A 349
 None
 0.97A 1df7A-1r76A:
undetectable		 1df7A-1r76A:
19.12
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.
1t2f L-LACTATE
DEHYDROGENASE B
CHAIN

(Homo sapiens) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		3 TRP A 148
ARG A 106
THR A 147
 None
OXQ  A 402 (-4.4A)
None
 0.85A 1df7A-1t2fA:
undetectable		 1df7A-1t2fA:
18.32
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.
1t61 TYPE IV COLLAGEN

(Bos taurus) 		PF01413
(C4) 		3 TRP A  82
ARG A  76
THR A  59
 None
 0.95A 1df7A-1t61A:
undetectable		 1df7A-1t61A:
22.50
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.
1u2v ACTIN-RELATED
PROTEIN 3

(Bos taurus) 		PF00022
(Actin) 		3 TRP A 153
ARG A 374
THR A 154
 None
ADP  A1001 (-3.3A)
None
 0.56A 1df7A-1u2vA:
undetectable		 1df7A-1u2vA:
18.42
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.
1vyx ORF K3

(Human
gammaherpesvirus
8) 		PF12906
(RINGv) 		3 TRP A  41
ARG A  60
THR A  43
 None
 0.96A 1df7A-1vyxA:
undetectable		 1df7A-1vyxA:
20.54
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.
1x9q 4M5.3
ANTI-FLUORESCEIN
SINGLE CHAIN
ANTIBODY FRAGMENT

(Homo sapiens) 		PF07686
(V-set) 		3 TRP A 115
ARG A  38
THR A 111
 FLU  A1341 (-4.8A)
None
None
 0.99A 1df7A-1x9qA:
undetectable		 1df7A-1x9qA:
18.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1xov PLY PROTEIN

(Listeria virus
PSA) 		PF01520
(Amidase_3) 		3 TRP A 267
ARG A  40
THR A 270
 None
 0.90A 1df7A-1xovA:
undetectable		 1df7A-1xovA:
20.06
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.
1y8a HYPOTHETICAL PROTEIN
AF1437

(Archaeoglobus
fulgidus) 		no annotation 3 TRP A   6
ARG A  74
THR A  13
 None
 1.01A 1df7A-1y8aA:
undetectable		 1df7A-1y8aA:
18.51
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.
2a14 INDOLETHYLAMINE
N-METHYLTRANSFERASE

(Homo sapiens) 		PF01234
(NNMT_PNMT_TEMT) 		3 TRP A 107
ARG A 123
THR A 108
 None
 0.93A 1df7A-2a14A:
undetectable		 1df7A-2a14A:
19.85
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.
2cow KINESIN-LIKE PROTEIN
KIF13B

(Homo sapiens) 		PF01302
(CAP_GLY) 		3 TRP A  53
ARG A  25
THR A  52
 None
 1.00A 1df7A-2cowA:
undetectable		 1df7A-2cowA:
22.64
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.
2fj0 CARBOXYLIC ESTER
HYDROLASE

(Manduca sexta) 		PF00135
(COesterase) 		3 TRP A  38
ARG A  56
THR A  34
 None
 0.92A 1df7A-2fj0A:
undetectable		 1df7A-2fj0A:
15.34
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.
2ilu ALDEHYDE
DEHYDROGENASE A

(Escherichia
coli) 		PF00171
(Aldedh) 		3 TRP A  60
ARG A 161
THR A 169
 None
 0.95A 1df7A-2iluA:
undetectable		 1df7A-2iluA:
17.12
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.
2j63 AP-ENDONUCLEASE

(Leishmania
major) 		PF03372
(Exo_endo_phos) 		3 TRP A 308
ARG A 299
THR A 307
 None
 0.79A 1df7A-2j63A:
undetectable		 1df7A-2j63A:
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.
2kh2 SCFV

(Mus musculus) 		PF07686
(V-set) 		3 TRP B 234
ARG B 173
THR B 233
 None
 1.01A 1df7A-2kh2B:
undetectable		 1df7A-2kh2B:
20.08
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.
2l6p PHAC1, PHAC2 AND
PHAD GENES

(Pseudomonas
aeruginosa) 		PF06155
(DUF971) 		3 TRP A  85
ARG A  94
THR A  84
 None
 0.87A 1df7A-2l6pA:
undetectable		 1df7A-2l6pA:
27.40
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.
2n9v DERMONECROTIC TOXIN

(Pasteurella
multocida) 		PF11647
(MLD) 		3 TRP A   4
ARG A  71
THR A   5
 None
 0.69A 1df7A-2n9vA:
undetectable		 1df7A-2n9vA:
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.
2o7p RIBOFLAVIN
BIOSYNTHESIS PROTEIN
RIBD

(Escherichia
coli) 		PF00383
(dCMP_cyt_deam_1)
PF01872
(RibD_C) 		3 TRP A 252
ARG A 237
THR A 269
 None
NAP  A 402 (-4.3A)
None
 0.95A 1df7A-2o7pA:
12.0		 1df7A-2o7pA:
19.21
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.
2ofq TRAO

(IncN plasmid
R46) 		PF03524
(CagX) 		3 TRP A 201
ARG A 265
THR A 207
 None
 0.92A 1df7A-2ofqA:
undetectable		 1df7A-2ofqA:
21.15
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.
2p6p GLYCOSYL TRANSFERASE

(Streptomyces
fradiae) 		PF06722
(DUF1205) 		3 TRP A 136
ARG A 190
THR A 135
 GOL  A1005 ( 3.7A)
None
None
 0.97A 1df7A-2p6pA:
undetectable		 1df7A-2p6pA:
20.05
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.
2q0o PROBABLE
TRANSCRIPTIONAL
ACTIVATOR PROTEIN
TRAR
PROBABLE
TRANSCRIPTIONAL
REPRESSOR TRAM

(Sinorhizobium
fredii) 		PF00196
(GerE)
PF03472
(Autoind_bind)
PF09228
(Prok-TraM) 		3 TRP C  44
ARG A 205
THR A 200
 None
 0.73A 1df7A-2q0oC:
undetectable		 1df7A-2q0oC:
21.48
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.
2qki COMPLEMENT C3

(Homo sapiens) 		PF01759
(NTR)
PF07677
(A2M_recep) 		3 TRP C1583
ARG C1560
THR C1604
 None
 0.85A 1df7A-2qkiC:
undetectable		 1df7A-2qkiC:
17.68
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.
2qki COMPLEMENT C3

(Homo sapiens) 		PF01759
(NTR)
PF07677
(A2M_recep) 		3 TRP C1605
ARG C1569
THR C1604
 None
 0.99A 1df7A-2qkiC:
undetectable		 1df7A-2qkiC:
17.68
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.
2rdy BH0842 PROTEIN

(Bacillus
halodurans) 		PF14498
(Glyco_hyd_65N_2) 		3 TRP A 732
ARG A 759
THR A 733
 None
 0.95A 1df7A-2rdyA:
undetectable		 1df7A-2rdyA:
11.08
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.
2v6e PROTELEMORASE

(Klebsiella
phage phiKO2) 		PF16684
(Telomere_res) 		3 TRP A 437
ARG A 396
THR A 436
 None
 0.93A 1df7A-2v6eA:
undetectable		 1df7A-2v6eA:
14.87
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.
2wda PUTATIVE SECRETED
LYASE

(Streptomyces
violaceoruber) 		PF02278
(Lyase_8)
PF02884
(Lyase_8_C)
PF08124
(Lyase_8_N) 		3 TRP A 599
ARG A  60
THR A 607
 None
 1.01A 1df7A-2wdaA:
undetectable		 1df7A-2wdaA:
12.42
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.
2wyh ALPHA-MANNOSIDASE

(Streptococcus
pyogenes) 		PF01074
(Glyco_hydro_38)
PF07748
(Glyco_hydro_38C)
PF09261
(Alpha-mann_mid) 		3 TRP A 114
ARG A 102
THR A  55
 None
GOL  A 904 (-4.1A)
None
 0.95A 1df7A-2wyhA:
undetectable		 1df7A-2wyhA:
10.67
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.
2xwb COMPLEMENT C3B
ALPHA' CHAIN

(Homo sapiens) 		PF00207
(A2M)
PF01759
(NTR)
PF07677
(A2M_recep)
PF07678
(A2M_comp)
PF10569
(Thiol-ester_cl) 		3 TRP B1605
ARG B1569
THR B1604
 None
 0.94A 1df7A-2xwbB:
undetectable		 1df7A-2xwbB:
11.56
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.
2yhg CELLULOSE-BINDING
PROTEIN

(Saccharophagus
degradans) 		PF07632
(DUF1593) 		3 TRP A 872
ARG A 766
THR A 913
 None
CL  A1935 (-4.7A)
None
 1.00A 1df7A-2yhgA:
0.8		 1df7A-2yhgA:
17.55
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.
3aib GLUCOSYLTRANSFERASE-
SI

(Streptococcus
mutans) 		PF02324
(Glyco_hydro_70) 		3 TRP A 299
ARG A 273
THR A 298
 None
 0.95A 1df7A-3aibA:
undetectable		 1df7A-3aibA:
11.02
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.
3bdv UNCHARACTERIZED
PROTEIN DUF1234

(Pectobacterium
atrosepticum) 		PF06821
(Ser_hydrolase) 		3 TRP A  44
ARG A  66
THR A  18
 None
 0.94A 1df7A-3bdvA:
undetectable		 1df7A-3bdvA:
22.34
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3dfr DIHYDROFOLATE
REDUCTASE

(Lactobacillus
casei) 		PF00186
(DHFR_1) 		3 TRP A   5
ARG A  31
THR A 116
 None
None
MTX  A 164 ( 4.3A)
 0.49A 1df7A-3dfrA:
22.5		 1df7A-3dfrA:
34.88
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.
3dou RIBOSOMAL RNA LARGE
SUBUNIT
METHYLTRANSFERASE J

(Thermoplasma
volcanium) 		PF01728
(FtsJ) 		3 TRP A  52
ARG A  81
THR A  53
 SAM  A   1 (-4.0A)
None
None
 0.84A 1df7A-3douA:
2.3		 1df7A-3douA:
19.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3h0n UNCHARACTERIZED
PROTEIN DUF1470

(Jannaschia sp.
CCS1) 		PF07336
(ABATE)
PF11706
(zf-CGNR) 		3 TRP A 109
ARG A   8
THR A 108
 None
None
GOL  A 205 ( 4.9A)
 1.01A 1df7A-3h0nA:
undetectable		 1df7A-3h0nA:
20.94
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.
3hzu THIOSULFATE
SULFURTRANSFERASE
SSEA

(Mycobacterium
tuberculosis) 		PF00581
(Rhodanese) 		3 TRP A 255
ARG A 246
THR A 254
 None
 0.82A 1df7A-3hzuA:
undetectable		 1df7A-3hzuA:
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.
3isa PUTATIVE ENOYL-COA
HYDRATASE/ISOMERASE

(Bordetella
parapertussis) 		PF00378
(ECH_1) 		3 TRP A  19
ARG A 124
THR A  20
 None
 0.92A 1df7A-3isaA:
undetectable		 1df7A-3isaA:
18.01
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.
3ita D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE
DACC

(Escherichia
coli) 		PF00768
(Peptidase_S11)
PF07943
(PBP5_C) 		3 TRP A 254
ARG A 244
THR A 253
 None
AIX  A 500 (-3.0A)
None
 0.95A 1df7A-3itaA:
undetectable		 1df7A-3itaA:
20.06
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.
3k2w BETAINE-ALDEHYDE
DEHYDROGENASE

(Pseudoalteromonas
atlantica) 		PF00171
(Aldedh) 		3 TRP A  64
ARG A 165
THR A 173
 None
 0.97A 1df7A-3k2wA:
undetectable		 1df7A-3k2wA:
15.00
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.
3kpx APOPHOTOPROTEIN
CLYTIN-3

(Clytia gregaria) 		PF13202
(EF-hand_5) 		3 TRP A  21
ARG A 115
THR A 184
 None
 0.84A 1df7A-3kpxA:
undetectable		 1df7A-3kpxA:
19.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3m1c ENVELOPE
GLYCOPROTEIN H

(Human
alphaherpesvirus
2) 		PF02489
(Herpes_glycop_H)
PF17488
(Herpes_glycoH_C) 		3 TRP A 244
ARG A 266
THR A 243
 None
 0.99A 1df7A-3m1cA:
undetectable		 1df7A-3m1cA:
11.55
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.
3m3p GLUTAMINE AMIDO
TRANSFERASE

(Methylobacillus
flagellatus) 		PF00117
(GATase) 		3 TRP A 228
ARG A 216
THR A 224
 None
 0.95A 1df7A-3m3pA:
undetectable		 1df7A-3m3pA:
24.30
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.
3ow2 50S RIBOSOMAL
PROTEIN L2P

(Haloarcula
marismortui) 		PF00181
(Ribosomal_L2)
PF03947
(Ribosomal_L2_C) 		3 TRP A 186
ARG A  51
THR A 184
 A  01847 ( 4.1A)
U  01874 ( 4.6A)
U  01879 ( 3.1A)
 0.88A 1df7A-3ow2A:
undetectable		 1df7A-3ow2A:
22.61
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.
3pfq PROTEIN KINASE C
BETA TYPE

(Rattus
norvegicus) 		PF00069
(Pkinase)
PF00130
(C1_1)
PF00168
(C2)
PF00433
(Pkinase_C) 		3 TRP A 223
ARG A 252
THR A 214
 None
 0.85A 1df7A-3pfqA:
undetectable		 1df7A-3pfqA:
13.22
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.
3qvf FOMA PROTEIN

(Streptomyces
wedmorensis) 		PF00696
(AA_kinase) 		3 TRP A 251
ARG A  34
THR A 245
 None
 0.93A 1df7A-3qvfA:
1.1		 1df7A-3qvfA:
22.15
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.
3zdp NUCLEOCAPSID PROTEIN

(Influenza A
virus) 		PF00506
(Flu_NP) 		3 TRP A 120
ARG A 175
THR A 130
 None
 0.94A 1df7A-3zdpA:
undetectable		 1df7A-3zdpA:
15.82
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.
4aov ISOCITRATE
DEHYDROGENASE [NADP]

(Desulfotalea
psychrophila) 		PF00180
(Iso_dh) 		3 TRP A 332
ARG A 396
THR A 333
 None
 0.99A 1df7A-4aovA:
2.4		 1df7A-4aovA:
18.64
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.
4auk RIBOSOMAL RNA LARGE
SUBUNIT
METHYLTRANSFERASE M

(Escherichia
coli) 		PF01728
(FtsJ) 		3 TRP A 225
ARG A 258
THR A 226
 None
 0.76A 1df7A-4aukA:
1.9		 1df7A-4aukA:
19.62
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.
4csd FUCOSE-BINDING
LECTIN PROTEIN

(Ralstonia
solanacearum) 		PF07938
(Fungal_lectin) 		3 TRP A  74
ARG A 108
THR A  71
 None
MFU  A 301 (-3.8A)
None
 0.96A 1df7A-4csdA:
undetectable		 1df7A-4csdA:
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.
4csd FUCOSE-BINDING
LECTIN PROTEIN

(Ralstonia
solanacearum) 		PF07938
(Fungal_lectin) 		3 TRP A 165
ARG A 199
THR A 162
 None
MFU  A 303 (-3.8A)
None
 1.00A 1df7A-4csdA:
undetectable		 1df7A-4csdA:
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.
4csd FUCOSE-BINDING
LECTIN PROTEIN

(Ralstonia
solanacearum) 		PF07938
(Fungal_lectin) 		3 TRP A 256
ARG A  17
THR A 253
 None
MFU  A 305 (-3.8A)
None
 0.99A 1df7A-4csdA:
undetectable		 1df7A-4csdA:
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.
4eog PUTATIVE
UNCHARACTERIZED
PROTEIN

(Pyrococcus
furiosus) 		PF09455
(Cas_DxTHG) 		3 TRP A  10
ARG A 212
THR A  33
 None
 1.00A 1df7A-4eogA:
1.3		 1df7A-4eogA:
16.95
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.
4hpn PUTATIVE
UNCHARACTERIZED
PROTEIN

(Agrobacterium
fabrum) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		3 TRP A 298
ARG A 374
THR A 300
 None
 0.82A 1df7A-4hpnA:
undetectable		 1df7A-4hpnA:
16.85
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.
4i6m ACTIN-RELATED
PROTEIN 7

(Saccharomyces
cerevisiae) 		PF00022
(Actin) 		3 TRP A 437
ARG A  88
THR A  17
 None
 0.99A 1df7A-4i6mA:
undetectable		 1df7A-4i6mA:
15.61
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.
4izx RICIN B-LIKE LECTIN

(Macrolepiota
procera) 		PF14200
(RicinB_lectin_2) 		3 TRP A 128
ARG A  89
THR A 127
 None
BAM  A 202 (-3.9A)
None
 0.99A 1df7A-4izxA:
undetectable		 1df7A-4izxA:
19.02
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.
4jxu PUTATIVE
AMINOTRANSFERASE

(Sinorhizobium
meliloti) 		PF01063
(Aminotran_4) 		3 TRP A 103
ARG A  63
THR A 119
 None
 0.99A 1df7A-4jxuA:
undetectable		 1df7A-4jxuA:
20.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4k6m POLYPROTEIN

(Japanese
encephalitis
virus) 		PF00972
(Flavi_NS5)
PF01728
(FtsJ) 		3 TRP A 171
ARG A 160
THR A 168
 None
 0.96A 1df7A-4k6mA:
undetectable		 1df7A-4k6mA:
10.59
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.
4nnb OBCA, OXALATE
BIOSYNTHETIC
COMPONENT A

(Burkholderia
glumae) 		PF05853
(BKACE) 		3 TRP A 494
ARG A 195
THR A 493
 None
 0.96A 1df7A-4nnbA:
undetectable		 1df7A-4nnbA:
15.19
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.
4o4f INOSITOL
HEXAKISPHOSPHATE
KINASE

(Entamoeba
histolytica) 		PF03770
(IPK) 		3 TRP A  58
ARG A  84
THR A  59
 None
 0.96A 1df7A-4o4fA:
undetectable		 1df7A-4o4fA:
18.80
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.
4o5p UNCHARACTERIZED
PROTEIN

(Pseudomonas
aeruginosa) 		PF09994
(DUF2235) 		3 TRP A 367
ARG A 350
THR A 368
 None
 0.98A 1df7A-4o5pA:
undetectable		 1df7A-4o5pA:
10.56
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.
4tx8 PROBABLE CHITINASE A

(Chromobacterium
violaceum) 		PF00704
(Glyco_hydro_18) 		3 TRP A 374
ARG A 388
THR A 373
 FLC  A 505 (-3.0A)
None
None
 0.76A 1df7A-4tx8A:
undetectable		 1df7A-4tx8A:
14.38
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.
4uer EIF3B

(Lachancea
kluyveri) 		PF00318
(Ribosomal_S2) 		3 TRP b 642
ARG b 688
THR b 641
 None
 0.98A 1df7A-4uerb:
undetectable		 1df7A-4uerb:
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.
4uy6 HISTIDINE-SPECIFIC
METHYLTRANSFERASE
EGTD

(Mycolicibacterium
smegmatis) 		PF10017
(Methyltransf_33) 		3 TRP A 307
ARG A  60
THR A  68
 None
None
TRS  A1801 (-4.0A)
 0.88A 1df7A-4uy6A:
2.0		 1df7A-4uy6A:
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.
4zel DOPAMINE
BETA-HYDROXYLASE

(Homo sapiens) 		PF01082
(Cu2_monooxygen)
PF03351
(DOMON)
PF03712
(Cu2_monoox_C) 		3 TRP A 104
ARG A  79
THR A 105
 None
 0.89A 1df7A-4zelA:
undetectable		 1df7A-4zelA:
13.98
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.
4zxb INSULIN RECEPTOR

(Homo sapiens) 		PF00041
(fn3)
PF00757
(Furin-like)
PF01030
(Recep_L_domain) 		3 TRP E 489
ARG E 498
THR E 568
 None
 0.83A 1df7A-4zxbE:
undetectable		 1df7A-4zxbE:
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.
5ch8 MONO- AND
DIACYLGLYCEROL
LIPASE

(Penicillium
cyclopium) 		PF01764
(Lipase_3)
PF03893
(Lipase3_N) 		3 TRP A 116
ARG A 175
THR A 156
 None
 0.97A 1df7A-5ch8A:
undetectable		 1df7A-5ch8A:
20.57
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.
5eyb DNA-BINDING PROTEIN
REB1

(Schizosaccharomyces
pombe) 		PF00249
(Myb_DNA-binding) 		3 TRP A 395
ARG A 352
THR A 396
 None
 0.92A 1df7A-5eybA:
undetectable		 1df7A-5eybA:
18.97
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.
5fcl CRISPR-ASSOCIATED
ENDONUCLEASE CAS1

(Pectobacterium
atrosepticum) 		PF01867
(Cas_Cas1) 		3 TRP A 243
ARG A 260
THR A 242
 None
 0.88A 1df7A-5fclA:
undetectable		 1df7A-5fclA:
18.02
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.
5gva WD REPEAT AND
HMG-BOX DNA-BINDING
PROTEIN 1

(Homo sapiens) 		PF00400
(WD40)
PF12894
(ANAPC4_WD40) 		3 TRP A 238
ARG A 287
THR A 237
 None
 1.00A 1df7A-5gvaA:
undetectable		 1df7A-5gvaA:
19.52
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.
5izd D-GLYCERALDEHYDE
DEHYDROGENASE
(NADP(+))

(Thermoplasma
acidophilum) 		PF00171
(Aldedh) 		3 TRP A  56
ARG A 157
THR A 165
 None
 0.88A 1df7A-5izdA:
undetectable		 1df7A-5izdA:
15.81
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.
5j6s ENDOPLASMIC
RETICULUM
AMINOPEPTIDASE 2

(Homo sapiens) 		PF01433
(Peptidase_M1)
PF11838
(ERAP1_C) 		3 TRP A 955
ARG A 674
THR A 951
 None
 0.83A 1df7A-5j6sA:
undetectable		 1df7A-5j6sA:
9.76
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.
5jjw SQUAMOUS CELL
CARCINOMA ANTIGEN
RECOGNIZED BY
T-CELLS 3

(Homo sapiens) 		no annotation 3 TRP A 382
ARG A 349
THR A 378
 None
EDO  A 601 (-4.2A)
None
 1.01A 1df7A-5jjwA:
undetectable		 1df7A-5jjwA:
19.29
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.
5kbp GLYCOSYL HYDROLASE,
FAMILY 38

(Enterococcus
faecalis) 		PF01074
(Glyco_hydro_38)
PF07748
(Glyco_hydro_38C)
PF09261
(Alpha-mann_mid) 		3 TRP A 114
ARG A 102
THR A  55
 None
 0.87A 1df7A-5kbpA:
undetectable		 1df7A-5kbpA:
10.51
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.
5ldd CCZ1

(Chaetomium
thermophilum) 		PF08217
(DUF1712) 		3 TRP B 242
ARG B 233
THR B 241
 None
 0.85A 1df7A-5lddB:
undetectable		 1df7A-5lddB:
21.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5mms CYSTATHIONINE
BETA-SYNTHASE

(Homo sapiens) 		PF00291
(PALP) 		3 TRP A 390
ARG A 182
THR A 383
 None
 0.86A 1df7A-5mmsA:
2.0		 1df7A-5mmsA:
16.91
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.
5ngy DSR-M GLUCANSUCRASE
INACTIVE MUTANT
E715Q

(Leuconostoc
citreum) 		no annotation 3 TRP A 479
ARG A 453
THR A 478
 None
 0.86A 1df7A-5ngyA:
undetectable		 1df7A-5ngyA:
8.22
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.
5oa3 EUKARYOTIC
TRANSLATION
INITIATION FACTOR 2D

(Homo sapiens) 		no annotation 3 TRP 0  99
ARG 0 164
THR 0  98
 None
 0.96A 1df7A-5oa30:
undetectable		 1df7A-5oa30:
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.
5ovo ADP-RIBOSYL-(DINITRO
GEN REDUCTASE)
HYDROLASE

(Azospirillum
brasilense) 		no annotation 3 TRP A 149
ARG A 176
THR A 150
 None
 0.99A 1df7A-5ovoA:
undetectable		 1df7A-5ovoA:
19.60
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.
5tf0 GLYCOSYL HYDROLASE
FAMILY 3 N-TERMINAL
DOMAIN PROTEIN

(Bacteroides
intestinalis) 		PF00933
(Glyco_hydro_3)
PF01915
(Glyco_hydro_3_C)
PF14310
(Fn3-like) 		3 TRP A 566
ARG A 560
THR A 565
 None
 0.95A 1df7A-5tf0A:
1.3		 1df7A-5tf0A:
11.74
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.
5ulv MALATE DEHYDROGENASE

(Methylobacterium
extorquens) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		3 TRP A 202
ARG A 185
THR A 203
 None
 0.99A 1df7A-5ulvA:
undetectable		 1df7A-5ulvA:
20.06
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.
5vsj ALPHA-1,4-GLUCAN:MAL
TOSE-1-PHOSPHATE
MALTOSYLTRANSFERASE
1

(Streptomyces
coelicolor) 		PF00128
(Alpha-amylase)
PF11896
(DUF3416) 		3 TRP A 114
ARG A 191
THR A 113
 None
 1.00A 1df7A-5vsjA:
undetectable		 1df7A-5vsjA:
12.79
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.
5xxo PERIPLASMIC
BETA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron) 		no annotation 3 TRP A 564
ARG A 558
THR A 563
 None
 1.00A 1df7A-5xxoA:
1.2		 1df7A-5xxoA:
20.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5y3r DNA-DEPENDENT
PROTEIN KINASE
CATALYTIC SUBUNIT

(Homo sapiens) 		PF00454
(PI3_PI4_kinase)
PF02259
(FAT)
PF02260
(FATC)
PF08163
(NUC194) 		3 TRP C4121
ARG C3965
THR C4120
 None
 0.96A 1df7A-5y3rC:
undetectable		 1df7A-5y3rC:
3.27
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.
5y9h SAFD,PUTATIVE OUTER
MEMBRANE
PROTEIN,PUTATIVE
OUTER MEMBRANE
PROTEIN,PUTATIVE
OUTER MEMBRANE
PROTEIN

(Salmonella
enterica) 		no annotation 3 TRP A 259
ARG A 246
THR A 221
 None
 0.98A 1df7A-5y9hA:
undetectable		 1df7A-5y9hA:
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.
5ykn PROBABLE
LYSINE-SPECIFIC
DEMETHYLASE JMJ14

(Arabidopsis
thaliana) 		no annotation 3 TRP A 455
ARG A 562
THR A 451
 None
 1.00A 1df7A-5yknA:
undetectable		 1df7A-5yknA:
16.35
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.
5yqq MEMBRANE-ANCHORED
LIPID-BINDING
PROTEIN YSP2

(Saccharomyces
cerevisiae) 		no annotation 3 TRP A1172
ARG A1167
THR A1178
 None
 0.65A 1df7A-5yqqA:
undetectable		 1df7A-5yqqA:
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.
5yud BACULOVIRAL IAP
REPEAT-CONTAINING
PROTEIN 1E

(Mus musculus) 		no annotation 3 TRP A 207
ARG A 144
THR A 194
 None
 0.82A 1df7A-5yudA:
undetectable		 1df7A-5yudA:
16.05
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.
6eoq DIPEPTIDYL PEPTIDASE
9

(Homo sapiens) 		no annotation 3 TRP A 210
ARG A 274
THR A 223
 None
 0.95A 1df7A-6eoqA:
undetectable		 1df7A-6eoqA:
19.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6fik POLYKETIDE SYNTHASE

(Cercospora
nicotianae) 		no annotation 3 TRP A 852
ARG A 903
THR A 851
 None
 0.87A 1df7A-6fikA:
undetectable		 1df7A-6fikA:
22.15