SIMILAR PATTERNS OF AMINO ACIDS FOR 3T3S_E_9PLE1_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.
1a0c XYLOSE ISOMERASE

(Thermoanaerobacterium
thermosulfurigenes) 		PF01261
(AP_endonuc_2) 		4 PHE A 211
PHE A 208
PHE A 186
THR A 140
 None
 1.02A 3t3sE-1a0cA:
0.0		 3t3sE-1a0cA:
21.19
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.
1bpl ALPHA-1,4-GLUCAN-4-G
LUCANOHYDROLASE

(Bacillus
licheniformis) 		PF00128
(Alpha-amylase)
PF09154
(DUF1939) 		5 PHE B 292
PHE B 343
PHE B 350
ALA B 349
THR B 353
 None
 1.49A 3t3sE-1bplB:
0.0		 3t3sE-1bplB:
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.
1d6n PROTEIN
(HYPOXANTHINE-GUANIN
E
PHOSPHORIBOSYLTRANSF
ERASE)

(Homo sapiens) 		PF00156
(Pribosyltran) 		4 ALA A 191
PHE A  98
PHE A  74
ALA A  75
 None
 1.00A 3t3sE-1d6nA:
0.0		 3t3sE-1d6nA:
19.91
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.
1hp1 5'-NUCLEOTIDASE

(Escherichia
coli) 		PF00149
(Metallophos)
PF02872
(5_nucleotid_C) 		4 ALA A 464
ASN A 465
ALA A 399
THR A 397
 None
 0.96A 3t3sE-1hp1A:
0.0		 3t3sE-1hp1A:
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.
1iq0 ARGINYL-TRNA
SYNTHETASE

(Thermus
thermophilus) 		PF00750
(tRNA-synt_1d)
PF03485
(Arg_tRNA_synt_N)
PF05746
(DALR_1) 		4 ALA A 222
PHE A 179
ALA A 180
THR A 159
 None
 0.97A 3t3sE-1iq0A:
0.0		 3t3sE-1iq0A:
22.14
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.
1j3n 3-OXOACYL-(ACYL-CARR
IER PROTEIN)
SYNTHASE II

(Thermus
thermophilus) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		4 PHE A 258
ALA A 280
ALA A 162
THR A 159
 None
 0.94A 3t3sE-1j3nA:
undetectable		 3t3sE-1j3nA:
23.68
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.
1lqt FPRA

(Mycobacterium
tuberculosis) 		PF07992
(Pyr_redox_2) 		4 ALA A 375
PHE A  76
ALA A  20
THR A  70
 None
ACT  A1871 ( 4.6A)
None
None
 0.97A 3t3sE-1lqtA:
0.0		 3t3sE-1lqtA:
20.87
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.
1nlu SEDOLISIN

(Pseudomonas sp.) 		no annotation 4 ALA A 303
PHE A 315
ASN A 304
PHE A 370
 None
 1.01A 3t3sE-1nluA:
0.0		 3t3sE-1nluA:
19.59
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.
1pp1 P40 NUCLEOPROTEIN

(Borna disease
virus) 		PF06407
(BDV_P40) 		4 ALA X 329
ASN X 301
ALA X 303
THR X 237
 None
 0.97A 3t3sE-1pp1X:
undetectable		 3t3sE-1pp1X:
22.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1prn PORIN

(Rhodobacter
blasticus) 		PF13609
(Porin_4) 		4 PHE A 195
ALA A  93
ALA A 199
THR A 207
 None
 1.12A 3t3sE-1prnA:
undetectable		 3t3sE-1prnA:
20.29
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.
1qgc PROTEIN (VIRUS
CAPSID PROTEIN VP3)

(Foot-and-mouth
disease virus) 		PF00073
(Rhv) 		4 PHE 3 209
ASN 3 106
ALA 3 203
THR 3  89
 None
 0.99A 3t3sE-1qgc3:
undetectable		 3t3sE-1qgc3:
18.61
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.
1rkx CDP-GLUCOSE-4,6-DEHY
DRATASE

(Yersinia
pseudotuberculosis) 		PF16363
(GDP_Man_Dehyd) 		4 ALA A  89
ASN A 107
ALA A 164
THR A 168
 NAD  A 360 (-3.3A)
None
None
None
 0.88A 3t3sE-1rkxA:
undetectable		 3t3sE-1rkxA:
19.88
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.
1sch PEANUT PEROXIDASE,
MAJOR CATIONIC
ISOZYME

(Arachis
hypogaea) 		PF00141
(peroxidase) 		4 PHE A 152
PHE A 157
ALA A 269
PHE A  41
 HEM  A 300 (-4.7A)
None
None
HEM  A 300 ( 4.0A)
 1.11A 3t3sE-1schA:
undetectable		 3t3sE-1schA:
20.70
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.
1t3i PROBABLE CYSTEINE
DESULFURASE

(Synechocystis
sp.) 		PF00266
(Aminotran_5) 		4 PHE A  17
ASN A 394
PHE A 392
ALA A  10
 None
 1.08A 3t3sE-1t3iA:
undetectable		 3t3sE-1t3iA:
22.87
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.
1uyv ACETYL-COA
CARBOXYLASE

(Saccharomyces
cerevisiae) 		PF01039
(Carboxyl_trans) 		4 PHE A1596
PHE A1604
ALA A1712
THR A1715
 None
 0.94A 3t3sE-1uyvA:
undetectable		 3t3sE-1uyvA:
22.25
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.
1wmr ISOPULLULANASE

(Aspergillus
niger) 		PF03718
(Glyco_hydro_49)
PF17433
(Glyco_hydro_49N) 		4 PHE A 154
ALA A 181
ALA A 108
THR A  62
 None
 1.01A 3t3sE-1wmrA:
undetectable		 3t3sE-1wmrA:
22.39
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.
1yy5 FMS1 PROTEIN

(Saccharomyces
cerevisiae) 		PF01593
(Amino_oxidase) 		4 PHE A 454
ALA A 452
ALA A 293
THR A 381
 None
 1.01A 3t3sE-1yy5A:
undetectable		 3t3sE-1yy5A:
24.45
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.
2czq CUTINASE-LIKE
PROTEIN

(Cryptococcus
sp. S-2) 		PF01083
(Cutinase) 		5 ALA A 205
PHE A 112
ASN A 199
PHE A 196
ALA A 197
 None
 1.38A 3t3sE-2czqA:
undetectable		 3t3sE-2czqA:
19.43
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.
2dmw SYNAPTOBREVIN-LIKE 1
VARIANT

(Homo sapiens) 		PF13774
(Longin) 		4 ASN A  84
PHE A  85
ALA A  82
THR A  73
 None
 1.02A 3t3sE-2dmwA:
undetectable		 3t3sE-2dmwA:
13.92
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.
2es3 THROMBOSPONDIN-1

(Homo sapiens) 		PF02210
(Laminin_G_2) 		4 PHE A 169
ALA A 177
PHE A  99
ALA A  88
 None
 0.99A 3t3sE-2es3A:
undetectable		 3t3sE-2es3A:
18.84
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.
2g2o MALONYL COA-ACYL
CARRIER PROTEIN
TRANSACYLASE

(Escherichia
coli) 		PF00698
(Acyl_transf_1) 		4 PHE A   8
PHE A 107
ALA A  72
THR A  32
 None
 1.04A 3t3sE-2g2oA:
undetectable		 3t3sE-2g2oA:
20.21
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.
2hlp MALATE DEHYDROGENASE

(Haloarcula
marismortui) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		4 ALA A 255
ASN A  39
ALA A  41
THR A  76
 None
 1.07A 3t3sE-2hlpA:
undetectable		 3t3sE-2hlpA:
23.31
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.
2i8b MINOR NUCLEOPROTEIN
VP30

(Zaire
ebolavirus) 		PF11507
(Transcript_VP30) 		4 PHE A 242
ALA A 155
PHE A 181
ASN A 244
 None
 1.00A 3t3sE-2i8bA:
undetectable		 3t3sE-2i8bA:
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.
2i9k MODIFICATION
METHYLASE HHAI

(Haemophilus
haemolyticus) 		PF00145
(DNA_methylase) 		4 PHE A  79
PHE A  18
ALA A 105
THR A 139
 None
SAH  A 328 (-4.9A)
None
None
 1.00A 3t3sE-2i9kA:
undetectable		 3t3sE-2i9kA:
20.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2obi PHOSPHOLIPID
HYDROPEROXIDE
GLUTATHIONE
PEROXIDASE (GPX4)

(Homo sapiens) 		PF00255
(GSHPx) 		4 PHE A  92
ASN A  76
ALA A  43
THR A  49
 None
 0.85A 3t3sE-2obiA:
undetectable		 3t3sE-2obiA:
18.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2oga TRANSAMINASE

(Streptomyces
venezuelae) 		PF01041
(DegT_DnrJ_EryC1) 		4 PHE A 187
PHE A 189
ALA A  53
THR A  58
 None
 1.01A 3t3sE-2ogaA:
undetectable		 3t3sE-2ogaA:
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.
2r26 CITRATE SYNTHASE

(Thermoplasma
acidophilum) 		PF00285
(Citrate_synt) 		4 PHE A  81
ALA A  85
ALA A 104
THR A 211
 None
 1.07A 3t3sE-2r26A:
undetectable		 3t3sE-2r26A:
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.
2w92 ENDO-BETA-N-ACETYLGL
UCOSAMINIDASE D

(Streptococcus
pneumoniae) 		PF03644
(Glyco_hydro_85) 		4 PHE A 409
ALA A 375
PHE A 471
PHE A 412
 NGT  A1809 ( 4.6A)
None
NGT  A1809 (-4.1A)
NGT  A1809 (-4.4A)
 1.13A 3t3sE-2w92A:
undetectable		 3t3sE-2w92A:
22.34
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.
2zzr UNSATURATED
GLUCURONYL HYDROLASE

(Streptococcus
agalactiae) 		PF07470
(Glyco_hydro_88) 		4 ALA A 143
PHE A 185
ALA A 186
THR A 190
 None
 0.82A 3t3sE-2zzrA:
undetectable		 3t3sE-2zzrA:
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.
3av6 DNA
(CYTOSINE-5)-METHYLT
RANSFERASE 1

(Mus musculus) 		PF00145
(DNA_methylase)
PF01426
(BAH)
PF02008
(zf-CXXC)
PF12047
(DNMT1-RFD) 		4 PHE A 631
ALA A 621
ASN A1248
PHE A1246
 None
 1.05A 3t3sE-3av6A:
undetectable		 3t3sE-3av6A:
16.45
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.
3dr2 EXPORTED
GLUCONOLACTONASE

(Xanthomonas
campestris) 		PF08450
(SGL) 		4 PHE A 244
ALA A 234
ALA A 219
THR A 201
 None
 0.97A 3t3sE-3dr2A:
undetectable		 3t3sE-3dr2A:
20.53
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3e4e CYTOCHROME P450 2E1

(Homo sapiens) 		PF00067
(p450) 		4 PHE A 116
PHE A 207
PHE A 298
ALA A 299
 None
None
None
HEM  A 500 ( 3.3A)
 1.03A 3t3sE-3e4eA:
54.4		 3t3sE-3e4eA:
51.14
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.
3ebj POLYMERASE ACIDIC
PROTEIN

(Influenza A
virus) 		PF00603
(Flu_PA) 		4 PHE A   4
PHE A   9
ASN A  33
ALA A  37
 None
 1.06A 3t3sE-3ebjA:
undetectable		 3t3sE-3ebjA:
19.58
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.
3ewb 2-ISOPROPYLMALATE
SYNTHASE

(Listeria
monocytogenes) 		PF00682
(HMGL-like) 		4 PHE X 265
ASN X 229
ALA X 239
THR X 210
 None
 0.97A 3t3sE-3ewbX:
undetectable		 3t3sE-3ewbX:
21.41
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.
3ezu GGDEF DOMAIN PROTEIN

(Geobacter
sulfurreducens) 		PF00990
(GGDEF) 		4 PHE A  39
ALA A  28
ALA A  44
THR A  47
 None
None
None
UNL  A 342 ( 4.3A)
 1.11A 3t3sE-3ezuA:
undetectable		 3t3sE-3ezuA:
22.24
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.
3g3z TRANSCRIPTIONAL
REGULATOR, MARR
FAMILY

(Neisseria
meningitidis) 		PF01047
(MarR) 		4 PHE A  18
PHE A  32
ALA A  33
THR A  37
 None
 0.83A 3t3sE-3g3zA:
undetectable		 3t3sE-3g3zA:
18.39
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.
3gbd SUCROSE ISOMERASE
SMUA FROM
PROTAMINOBACTER
RUBRUM

(Serratia
plymuthica) 		PF00128
(Alpha-amylase)
PF16657
(Malt_amylase_C) 		4 PHE A 377
ALA A 374
PHE A 292
ALA A 291
 None
 1.12A 3t3sE-3gbdA:
undetectable		 3t3sE-3gbdA:
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.
3ivu HOMOCITRATE
SYNTHASE,
MITOCHONDRIAL

(Schizosaccharomyces
pombe) 		PF00682
(HMGL-like) 		4 PHE A  35
ALA A 244
ALA A 236
THR A 261
 None
 1.02A 3t3sE-3ivuA:
undetectable		 3t3sE-3ivuA:
21.41
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.
3k13 5-METHYLTETRAHYDROFO
LATE-HOMOCYSTEINE
METHYLTRANSFERASE

(Bacteroides
thetaiotaomicron) 		PF00809
(Pterin_bind) 		4 ASN A 561
PHE A 564
ALA A 524
THR A 527
 THH  A 642 ( 3.3A)
None
None
None
 0.92A 3t3sE-3k13A:
undetectable		 3t3sE-3k13A:
21.73
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.
3m62 UBIQUITIN
CONJUGATION FACTOR
E4

(Saccharomyces
cerevisiae) 		PF04564
(U-box)
PF10408
(Ufd2P_core) 		4 PHE A 194
PHE A 181
ASN A 149
PHE A 152
 None
 1.10A 3t3sE-3m62A:
undetectable		 3t3sE-3m62A:
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.
3om8 PROBABLE HYDROLASE

(Pseudomonas
aeruginosa) 		PF00561
(Abhydrolase_1) 		4 ALA A 122
PHE A 174
ASN A 123
THR A  36
 None
 1.07A 3t3sE-3om8A:
undetectable		 3t3sE-3om8A:
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.
3s5k FALCILYSIN

(Plasmodium
falciparum) 		PF00675
(Peptidase_M16)
PF05193
(Peptidase_M16_C)
PF08367
(M16C_assoc) 		4 PHE A 762
PHE A 924
ASN A 769
ALA A 836
 None
 1.06A 3t3sE-3s5kA:
undetectable		 3t3sE-3s5kA:
16.43
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.
3tij NUPC FAMILY PROTEIN

(Vibrio cholerae) 		PF01773
(Nucleos_tra2_N)
PF07662
(Nucleos_tra2_C)
PF07670
(Gate) 		4 PHE A 216
ALA A 182
ASN A 405
ALA A 408
 None
 0.96A 3t3sE-3tijA:
undetectable		 3t3sE-3tijA:
23.17
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.
3zdr ALCOHOL
DEHYDROGENASE DOMAIN
OF THE BIFUNCTIONAL
ACETALDEHYDE
DEHYDROGENASE

(Parageobacillus
thermoglucosidasius) 		PF00465
(Fe-ADH) 		4 ALA A 848
ASN A 673
ALA A 675
THR A 679
 CSO  A 845 ( 3.9A)
None
None
None
 0.89A 3t3sE-3zdrA:
undetectable		 3t3sE-3zdrA:
23.01
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.
4awm POLYMERASE PA

(Influenza A
virus) 		PF00603
(Flu_PA) 		4 PHE A   9
ASN A  33
ALA A  37
THR A  40
 None
None
KDH  A 911 (-3.3A)
None
 0.97A 3t3sE-4awmA:
undetectable		 3t3sE-4awmA:
16.39
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.
4ayr MANNOSYL-OLIGOSACCHA
RIDE
1,2-ALPHA-MANNOSIDAS
E

(Caulobacter sp.
K31) 		PF01532
(Glyco_hydro_47) 		4 ALA A 277
PHE A 237
PHE A 297
ALA A 242
 None
 0.96A 3t3sE-4ayrA:
undetectable		 3t3sE-4ayrA:
21.57
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.
4az1 TYROSINE SPECIFIC
PROTEIN PHOSPHATASE

(Trypanosoma
cruzi) 		PF00102
(Y_phosphatase) 		4 ALA A  56
ASN A  80
ALA A  92
THR A 233
 None
 1.11A 3t3sE-4az1A:
undetectable		 3t3sE-4az1A:
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.
4d60 PROFILIN

(Plasmodium
falciparum) 		PF00235
(Profilin) 		4 PHE A 106
ASN A 148
ALA A 152
THR A 155
 None
 1.11A 3t3sE-4d60A:
undetectable		 3t3sE-4d60A:
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.
4eay MANNONATE
DEHYDRATASE

(Escherichia
coli) 		PF03786
(UxuA) 		4 ASN A 211
PHE A 212
ALA A 213
THR A 260
 None
 0.91A 3t3sE-4eayA:
undetectable		 3t3sE-4eayA:
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.
4eff AROMATIC-AMINO-ACID
AMINOTRANSFERASE

(Burkholderia
pseudomallei) 		PF00155
(Aminotran_1_2) 		4 PHE A 115
ALA A 100
PHE A 241
THR A 264
 None
 0.99A 3t3sE-4effA:
undetectable		 3t3sE-4effA:
21.96
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.
4gom DNA ADENINE
METHYLASE

(Escherichia
coli) 		PF02086
(MethyltransfD12) 		4 PHE D 160
PHE D  42
PHE D 151
ALA D 152
 None
 1.11A 3t3sE-4gomD:
undetectable		 3t3sE-4gomD:
19.54
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.
4hoz SUCROSE ISOMERASE

(Erwinia
rhapontici) 		PF00128
(Alpha-amylase)
PF16657
(Malt_amylase_C) 		4 PHE A 551
ALA A 388
PHE A 377
ALA A 373
 None
 1.03A 3t3sE-4hozA:
undetectable		 3t3sE-4hozA:
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.
4lgq PUTATIVE POLYKETIDE
CYCLASE

(Chromobacterium
violaceum) 		PF07366
(SnoaL) 		4 PHE A  15
ALA A  29
PHE A  52
ALA A  53
 None
 1.02A 3t3sE-4lgqA:
undetectable		 3t3sE-4lgqA:
13.79
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.
4m5o POLYMERASE PA

(Influenza A
virus) 		PF00603
(Flu_PA) 		4 PHE A   4
PHE A   9
ASN A  33
ALA A  37
 None
None
SO4  A 304 (-3.7A)
X48  A 306 ( 3.7A)
 1.10A 3t3sE-4m5oA:
undetectable		 3t3sE-4m5oA:
17.02
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.
4nen INTEGRIN ALPHA-X

(Homo sapiens) 		PF00092
(VWA)
PF01839
(FG-GAP)
PF08441
(Integrin_alpha2) 		4 PHE A  18
PHE A  11
ALA A  56
THR A  54
 None
 0.99A 3t3sE-4nenA:
undetectable		 3t3sE-4nenA:
18.79
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.
4nfz POLYMERASE PA

(Influenza A
virus) 		PF00603
(Flu_PA) 		4 PHE A   9
ASN A  33
ALA A  37
THR A  40
 None
 1.08A 3t3sE-4nfzA:
undetectable		 3t3sE-4nfzA:
18.12
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.
4nl4 PRIMOSOME ASSEMBLY
PROTEIN PRIA

(Klebsiella
pneumoniae) 		PF00270
(DEAD)
PF00271
(Helicase_C) 		4 ALA H 620
PHE H 573
ALA H 574
THR H 578
 None
 1.04A 3t3sE-4nl4H:
undetectable		 3t3sE-4nl4H:
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.
4nqf NUCLEOTIDYLTRANSFERA
SE

(Agrobacterium
fabrum) 		PF05168
(HEPN) 		4 PHE A 192
ALA A 178
ALA A 197
THR A 200
 None
 1.04A 3t3sE-4nqfA:
undetectable		 3t3sE-4nqfA:
16.20
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.
4ntd THIOREDOXIN
REDUCTASE

(Streptomyces
clavuligerus) 		PF07992
(Pyr_redox_2) 		4 ALA A  30
ASN A 298
PHE A 295
ALA A 294
 None
 1.08A 3t3sE-4ntdA:
undetectable		 3t3sE-4ntdA:
19.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4r9z UNCHARACTERIZED
PROTEIN

(Mycobacterium
avium) 		PF13622
(4HBT_3) 		4 ALA A 103
PHE A  22
ALA A  47
THR A  50
 None
 1.05A 3t3sE-4r9zA:
undetectable		 3t3sE-4r9zA:
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.
4rc6 ALDEHYDE
DECARBONYLASE

(Synechococcus
elongatus) 		PF11266
(Ald_deCOase) 		4 PHE B  87
ALA B  35
PHE B 117
ALA B 118
 None
FE2  B 301 ( 4.3A)
None
None
 0.90A 3t3sE-4rc6B:
undetectable		 3t3sE-4rc6B:
18.91
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.
4rdc AMINO ACID/AMIDE ABC
TRANSPORTER
SUBSTRATE-BINDING
PROTEIN, HAAT FAMILY

(Trichormus
variabilis) 		PF13458
(Peripla_BP_6) 		4 ALA A 135
ASN A 154
PHE A 204
ALA A 156
 None
None
PRO  A 501 (-3.4A)
PRO  A 501 ( 4.9A)
 1.03A 3t3sE-4rdcA:
undetectable		 3t3sE-4rdcA:
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.
4ucl RNA-DIRECTED RNA
POLYMERASE L

(Human
metapneumovirus) 		no annotation 4 ALA A1704
ASN A1701
PHE A1667
ALA A1699
 None
 1.12A 3t3sE-4uclA:
undetectable		 3t3sE-4uclA:
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.
4wep PUTATIVE
OSMOPROTECTANT
UPTAKE SYSTEM
SUBSTRATE-BINDING
PROTEIN OSMF

(Escherichia
coli) 		PF04069
(OpuAC) 		4 PHE A 160
ALA A 206
ALA A 133
THR A 131
 None
 1.13A 3t3sE-4wepA:
undetectable		 3t3sE-4wepA:
21.04
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.
4wl2 PUTATIVE EXPORTED
CHOLOYLGLYCINE
HYDROLASE

(Pectobacterium
atrosepticum) 		PF02275
(CBAH) 		4 PHE A 133
PHE A 344
ALA A 111
THR A  72
 None
 1.07A 3t3sE-4wl2A:
undetectable		 3t3sE-4wl2A:
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.
4wxx DNA
(CYTOSINE-5)-METHYLT
RANSFERASE 1

(Homo sapiens) 		PF00145
(DNA_methylase)
PF01426
(BAH)
PF02008
(zf-CXXC)
PF12047
(DNMT1-RFD) 		4 PHE A 628
ALA A 618
ASN A1245
PHE A1243
 None
 1.13A 3t3sE-4wxxA:
undetectable		 3t3sE-4wxxA:
17.33
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.
4yu5 IMMUNE INHIBITOR A,
METALLOPROTEASE

(Bacillus cereus) 		PF05547
(Peptidase_M6) 		4 ALA A 770
PHE A 745
PHE A 705
THR A 714
 None
 1.07A 3t3sE-4yu5A:
undetectable		 3t3sE-4yu5A:
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.
4z9r OMEGA-3
POLYUNSATURATED
FATTY ACID SYNTHASE
SUBUNIT PFAD

(Shewanella
oneidensis) 		PF03060
(NMO) 		4 ALA A 108
ASN A 160
PHE A 159
ALA A 158
 FMN  A 602 (-4.2A)
FMN  A 602 (-3.6A)
None
None
 1.08A 3t3sE-4z9rA:
undetectable		 3t3sE-4z9rA:
23.55
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.
5a8r METHYL-COENZYME M
REDUCTASE II,
SUBUNIT BETA

(Methanothermobacter
marburgensis) 		PF02240
(MCR_gamma) 		4 PHE C 146
ALA C  97
PHE C  90
ALA C  91
 None
 0.97A 3t3sE-5a8rC:
undetectable		 3t3sE-5a8rC:
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.
5aex AMMONIUM TRANSPORTER
MEP2

(Saccharomyces
cerevisiae) 		PF00909
(Ammonium_transp) 		4 ALA A  88
PHE A 132
ALA A 133
THR A 136
 None
 1.01A 3t3sE-5aexA:
undetectable		 3t3sE-5aexA:
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.
5b04 PROBABLE TRANSLATION
INITIATION FACTOR
EIF-2B SUBUNIT
EPSILON

(Schizosaccharomyces
pombe) 		PF00132
(Hexapep)
PF00483
(NTP_transferase) 		4 PHE I 123
ASN I 228
ALA I 232
THR I 235
 None
 1.06A 3t3sE-5b04I:
undetectable		 3t3sE-5b04I:
20.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5cnl ICML-LIKE

(Legionella
pneumophila) 		PF11393
(T4BSS_DotI_IcmL) 		4 ALA A 107
PHE A  59
ALA A  36
THR A  40
 None
 1.12A 3t3sE-5cnlA:
undetectable		 3t3sE-5cnlA:
14.80
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.
5csl ACETYL-COA
CARBOXYLASE

(Saccharomyces
cerevisiae) 		PF00289
(Biotin_carb_N)
PF00364
(Biotin_lipoyl)
PF01039
(Carboxyl_trans)
PF02785
(Biotin_carb_C)
PF02786
(CPSase_L_D2)
PF08326
(ACC_central) 		4 PHE A1596
PHE A1604
ALA A1712
THR A1715
 None
 1.02A 3t3sE-5cslA:
undetectable		 3t3sE-5cslA:
11.68
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.
5eyf GLUTAMATE ABC
SUPERFAMILY ATP
BINDING CASSETTE
TRANSPORTER, BINDING
PROTEIN

(Enterococcus
faecium) 		PF00497
(SBP_bac_3) 		4 PHE A 262
ALA A 131
ASN A 201
THR A  51
 None
 0.92A 3t3sE-5eyfA:
undetectable		 3t3sE-5eyfA:
16.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5f5n MONOOXYGENASE

(Micromonospora
sp. TP-A0468) 		PF05368
(NmrA) 		4 PHE A 281
PHE A 155
PHE A 222
ALA A 219
 None
5VD  A 302 (-3.8A)
None
None
 1.04A 3t3sE-5f5nA:
undetectable		 3t3sE-5f5nA:
21.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5gv1 ENDO-1,4-BETA-XYLANA
SE

(termite gut
metagenome) 		PF00457
(Glyco_hydro_11) 		4 PHE A 150
ALA A 245
PHE A 252
ALA A  74
 None
 1.02A 3t3sE-5gv1A:
undetectable		 3t3sE-5gv1A:
20.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5gyg ENDO-1,4-BETA-XYLANA
SE

(termite gut
metagenome) 		PF00457
(Glyco_hydro_11) 		4 PHE A 150
ALA A 245
PHE A 252
ALA A  74
 None
 0.98A 3t3sE-5gygA:
undetectable		 3t3sE-5gygA:
19.96
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.
5hgc SERPIN

(Taeniopygia
guttata) 		PF00079
(Serpin) 		4 PHE A 101
ASN A  35
PHE A  38
ALA A  39
 None
 0.86A 3t3sE-5hgcA:
undetectable		 3t3sE-5hgcA:
20.64
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.
5i6g ACETYL-COA
CARBOXYLASE-LIKE
PROTEIN,ACETYL-COA
CARBOXYLASE-LIKE
PROTEIN

(Chaetomium
thermophilum) 		PF01039
(Carboxyl_trans)
PF08326
(ACC_central) 		4 PHE A1641
PHE A1649
ALA A1752
THR A1755
 None
 0.87A 3t3sE-5i6gA:
undetectable		 3t3sE-5i6gA:
17.93
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.
5i6h ACETYL-COA
CARBOXYLASE-LIKE
PROTEIN

(Chaetomium
thermophilum) 		PF01039
(Carboxyl_trans)
PF08326
(ACC_central) 		4 PHE A1641
PHE A1649
ALA A1752
THR A1755
 None
 0.92A 3t3sE-5i6hA:
undetectable		 3t3sE-5i6hA:
15.74
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.
5i6i ACETYL-COA
CARBOXYLASE-LIKE
PROTEIN,ACETYL-COA
CARBOXYLASE-LIKE
PROTEIN,ACETYL-COA
CARBOXYLASE-LIKE
PROTEIN

(Chaetomium
thermophilum) 		PF01039
(Carboxyl_trans)
PF08326
(ACC_central) 		4 PHE A1641
PHE A1649
ALA A1752
THR A1755
 None
 0.88A 3t3sE-5i6iA:
undetectable		 3t3sE-5i6iA:
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.
5j9r CHOLOYLGLYCINE
HYDROLASE

(Agrobacterium
tumefaciens) 		PF02275
(CBAH) 		4 PHE A 124
PHE A 323
ALA A 102
THR A  65
 None
 1.11A 3t3sE-5j9rA:
undetectable		 3t3sE-5j9rA:
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.
5k53 ALDEHYDE
DEFORMYLATING
OXYGENASE

(Oscillatoria
sp.) 		PF11266
(Ald_deCOase) 		4 PHE A  87
ALA A  35
PHE A 117
ALA A 118
 None
STE  A 502 (-3.5A)
STE  A 502 (-3.8A)
STE  A 502 ( 3.9A)
 1.00A 3t3sE-5k53A:
undetectable		 3t3sE-5k53A:
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.
5kzm TRYPTOPHAN SYNTHASE
BETA CHAIN

(Francisella
tularensis) 		PF00291
(PALP) 		4 PHE B 278
ALA B 283
ALA B 191
THR B 189
 None
None
None
LLP  B  86 ( 3.8A)
 1.05A 3t3sE-5kzmB:
undetectable		 3t3sE-5kzmB:
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.
5lc5 NADH-UBIQUINONE
OXIDOREDUCTASE CHAIN
1

(Bos taurus) 		PF00146
(NADHdh) 		4 PHE H 186
PHE H 270
ASN H 235
ALA H 239
 None
 0.97A 3t3sE-5lc5H:
undetectable		 3t3sE-5lc5H:
21.13
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.
5mun LYS-GINGIPAIN W83

(Porphyromonas
gingivalis) 		PF08126
(Propeptide_C25) 		4 PHE A  49
ALA A  28
ASN A 191
THR A  34
 None
 1.13A 3t3sE-5munA:
undetectable		 3t3sE-5munA:
17.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5n1q METHYL-COENZYME M
REDUCTASE III FROM
METHANOTHERMOCOCCUS
THERMOLITHOTROPHICUS
SUBUNIT GAMMA

(Methanothermococcus
thermolithotrophicus) 		PF02240
(MCR_gamma) 		4 PHE C 147
ALA C  97
PHE C  90
ALA C  91
 None
 0.98A 3t3sE-5n1qC:
undetectable		 3t3sE-5n1qC:
18.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5net O1 MANISA VP3

(Foot-and-mouth
disease virus) 		PF00073
(Rhv) 		4 PHE 3 209
ASN 3 106
ALA 3 203
THR 3  89
 None
 1.08A 3t3sE-5net3:
undetectable		 3t3sE-5net3:
18.79
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.
5t2x UNCHARACTERIZED
PROTEIN LPG1670

(Legionella
pneumophila) 		no annotation 4 PHE A  83
ASN A 218
PHE A 222
ALA A 220
 None
 1.12A 3t3sE-5t2xA:
undetectable		 3t3sE-5t2xA:
19.05
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.
5t3t FUSION PROTEIN OF
NUCLEOPROTEIN AND
MINOR NUCLEOPROTEIN
VP30

(Zaire
ebolavirus) 		PF05505
(Ebola_NP)
PF11507
(Transcript_VP30) 		4 PHE A 242
ALA A 155
PHE A 181
ASN A 244
 None
 1.11A 3t3sE-5t3tA:
undetectable		 3t3sE-5t3tA:
16.63
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.
5t5i TUNGSTEN
FORMYLMETHANOFURAN
DEHYDROGENASE
SUBUNIT B
TUNGSTEN
FORMYLMETHANOFURAN
DEHYDROGENASE
SUBUNIT FWDD

(Methanothermobacter
sp. CaT2;
Methanothermobacter
wolfeii) 		PF00384
(Molybdopterin)
PF01568
(Molydop_binding) 		4 PHE D 100
ASN D  85
PHE B 349
THR B 372
 MGD  B 503 (-3.7A)
MGD  B 503 (-3.2A)
None
None
 1.08A 3t3sE-5t5iD:
undetectable		 3t3sE-5t5iD:
15.05
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.
5u1o GLUTATHIONE
REDUCTASE

(Vibrio
parahaemolyticus) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		4 PHE A 164
ALA A 264
ALA A 187
THR A 197
 None
 1.10A 3t3sE-5u1oA:
undetectable		 3t3sE-5u1oA:
20.83
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.
5vao MINOR NUCLEOPROTEIN
VP30

(Zaire
ebolavirus) 		PF11507
(Transcript_VP30) 		4 PHE A 242
ALA A 155
PHE A 181
ASN A 244
 None
 1.11A 3t3sE-5vaoA:
undetectable		 3t3sE-5vaoA:
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.
5vap MINOR NUCLEOPROTEIN
VP30

(Zaire
ebolavirus) 		PF11507
(Transcript_VP30) 		4 PHE A 242
ALA A 155
PHE A 181
ASN A 244
 None
 1.12A 3t3sE-5vapA:
undetectable		 3t3sE-5vapA:
12.24
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.
5vkt CINNAMYL ALCOHOL
DEHYDROGENASES
(SBCAD4)

(Sorghum bicolor) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		4 PHE A 201
PHE A 205
ALA A 175
ALA A 310
 None
 0.79A 3t3sE-5vktA:
undetectable		 3t3sE-5vktA:
21.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5w4z RIBOFLAVIN LYASE

(Herbiconiux) 		no annotation 4 PHE A  14
ASN A  16
ALA A  63
THR A 143
 RBF  A 502 (-3.6A)
RBF  A 502 (-3.8A)
RBF  A 502 ( 3.8A)
None
 1.09A 3t3sE-5w4zA:
undetectable		 3t3sE-5w4zA:
11.76
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 4 PHE A 108
PHE A 297
ALA A 298
THR A 302
 9ZJ  A 502 (-4.4A)
9ZJ  A 502 ( 4.5A)
9ZJ  A 502 ( 3.5A)
9ZJ  A 502 ( 3.9A)
 0.25A 3t3sE-5wbgA:
54.9		 3t3sE-5wbgA:
65.00
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.
5xoi OXIDOREDUCTASE,
2OG-FE OXYGENASE
FAMILY PROTEIN,
PUTATIVE, EXPRESSED

(Oryza sativa) 		no annotation 4 PHE A 368
PHE A 229
ASN A 365
PHE A 298
 None
None
SIN  A 401 (-3.5A)
None
 1.08A 3t3sE-5xoiA:
undetectable		 3t3sE-5xoiA:
9.85
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.
5yh5 NICKEL ABC
TRANSPORTER
SUBSTRATE-BINDING
PROTEIN

(Staphylococcus
aureus) 		no annotation 4 PHE A 501
PHE A 221
ALA A 199
THR A  15
 None
 0.99A 3t3sE-5yh5A:
undetectable		 3t3sE-5yh5A:
10.84
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.
6elw PHOSPHOLIPID
HYDROPEROXIDE
GLUTATHIONE
PEROXIDASE,
MITOCHONDRIAL

(Homo sapiens) 		no annotation 4 PHE A  92
ASN A  76
ALA A  43
THR A  49
 None
None
SE7  A  46 ( 4.6A)
SE7  A  46 ( 3.7A)
 0.93A 3t3sE-6elwA:
undetectable		 3t3sE-6elwA:
9.32