SIMILAR PATTERNS OF AMINO ACIDS FOR 6NMF_W_CHDW101

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.
1abr ABRIN-A

(Abrus
precatorius) 		PF00161
(RIP) 		4 ILE A 138
LEU A 134
ARG A  79
THR A  53
 None
 1.08A 6nmfN-1abrA:
0.0
6nmfW-1abrA:
0.0		 6nmfN-1abrA:
18.68
6nmfW-1abrA:
11.11
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.
1b89 PROTEIN (CLATHRIN
HEAVY CHAIN)

(Bos taurus) 		PF00637
(Clathrin) 		4 ILE A1287
LEU A1283
MET A1302
THR A1301
 None
 1.01A 6nmfN-1b89A:
undetectable
6nmfW-1b89A:
0.0		 6nmfN-1b89A:
19.78
6nmfW-1b89A:
8.04
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.
1go3 DNA-DIRECTED RNA
POLYMERASE SUBUNIT E

(Methanocaldococcus
jannaschii) 		PF00575
(S1)
PF03876
(SHS2_Rpb7-N) 		4 ILE E 176
LEU E 173
MET E 165
THR E 164
 None
 1.03A 6nmfN-1go3E:
undetectable
6nmfW-1go3E:
0.0		 6nmfN-1go3E:
14.98
6nmfW-1go3E:
15.06
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.
1gyn FRUCTOSE-BISPHOSPHAT
E ALDOLASE II

(Escherichia
coli) 		PF01116
(F_bP_aldolase) 		4 ILE A 119
LEU A 122
MET A 169
THR A 170
 None
 0.98A 6nmfN-1gynA:
undetectable
6nmfW-1gynA:
0.1		 6nmfN-1gynA:
20.57
6nmfW-1gynA:
11.35
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.
1i60 IOLI PROTEIN

(Bacillus
subtilis) 		PF01261
(AP_endonuc_2) 		4 ILE A 139
LEU A 128
MET A  90
THR A  92
 None
 1.11A 6nmfN-1i60A:
undetectable
6nmfW-1i60A:
undetectable		 6nmfN-1i60A:
18.79
6nmfW-1i60A:
14.14
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.
1iq0 ARGINYL-TRNA
SYNTHETASE

(Thermus
thermophilus) 		PF00750
(tRNA-synt_1d)
PF03485
(Arg_tRNA_synt_N)
PF05746
(DALR_1) 		4 ILE A 149
LEU A 237
MET A 227
THR A 226
 None
 0.90A 6nmfN-1iq0A:
0.0
6nmfW-1iq0A:
0.0		 6nmfN-1iq0A:
22.20
6nmfW-1iq0A:
8.17
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.
1iyr DNA FRAGMENTATION
FACTOR ALPHA SUBUNIT

(Homo sapiens) 		PF09033
(DFF-C) 		4 ILE A  21
LEU A  22
ARG A   9
THR A   5
 None
 0.92A 6nmfN-1iyrA:
undetectable
6nmfW-1iyrA:
0.0		 6nmfN-1iyrA:
10.96
6nmfW-1iyrA:
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.
1jed SULFATE
ADENYLYLTRANSFERASE

(Saccharomyces
cerevisiae) 		PF01747
(ATP-sulfurylase)
PF14306
(PUA_2) 		4 ILE A  48
LEU A  49
ARG A  40
THR A  38
 None
 1.01A 6nmfN-1jedA:
0.0
6nmfW-1jedA:
0.0		 6nmfN-1jedA:
21.17
6nmfW-1jedA:
8.97
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.
1mc8 FLAP ENDONUCLEASE-1

(Pyrococcus
horikoshii) 		PF00752
(XPG_N)
PF00867
(XPG_I) 		4 ILE A   5
LEU A   8
ARG A 223
THR A 222
 None
 0.71A 6nmfN-1mc8A:
0.0
6nmfW-1mc8A:
0.0		 6nmfN-1mc8A:
20.59
6nmfW-1mc8A:
10.20
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.
1mhz METHANE
MONOOXYGENASE
HYDROXYLASE

(Methylosinus
trichosporium) 		PF02332
(Phenol_Hydrox) 		4 ILE D 318
LEU D 321
ARG D 330
THR D 269
 None
 1.10A 6nmfN-1mhzD:
0.5
6nmfW-1mhzD:
undetectable		 6nmfN-1mhzD:
21.42
6nmfW-1mhzD:
6.50
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.
1nig HYPOTHETICAL PROTEIN
TA1238

(Thermoplasma
acidophilum) 		PF09155
(DUF1940) 		4 ILE A  54
LEU A  51
ARG A 104
MET A 100
 None
 0.98A 6nmfN-1nigA:
0.0
6nmfW-1nigA:
undetectable		 6nmfN-1nigA:
13.13
6nmfW-1nigA:
18.18
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.
1nt4 GLUCOSE-1-PHOSPHATAS
E

(Escherichia
coli) 		PF00328
(His_Phos_2) 		4 ILE A 293
LEU A 296
TYR A 305
THR A 363
 None
 1.10A 6nmfN-1nt4A:
undetectable
6nmfW-1nt4A:
undetectable		 6nmfN-1nt4A:
21.40
6nmfW-1nt4A:
12.37
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.
1oa1 HYDROXYLAMINE
REDUCTASE

(Desulfovibrio
vulgaris) 		PF03063
(Prismane) 		4 ILE A  41
LEU A  38
ARG A  95
THR A 121
 None
 1.12A 6nmfN-1oa1A:
undetectable
6nmfW-1oa1A:
undetectable		 6nmfN-1oa1A:
25.04
6nmfW-1oa1A:
8.65
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.
1ofm CHONDROITINASE B

(Pedobacter
heparinus) 		PF14592
(Chondroitinas_B) 		4 ILE A 304
TYR A 283
MET A 268
THR A 267
 None
 1.14A 6nmfN-1ofmA:
undetectable
6nmfW-1ofmA:
undetectable		 6nmfN-1ofmA:
20.00
6nmfW-1ofmA:
9.62
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.
1ojz ADP-RIBOSYLTRANSFERA
SE

(Staphylococcus
aureus) 		PF03496
(ADPrib_exo_Tox) 		4 ILE A  95
LEU A  92
TYR A 189
THR A 206
 None
 1.11A 6nmfN-1ojzA:
undetectable
6nmfW-1ojzA:
undetectable		 6nmfN-1ojzA:
18.12
6nmfW-1ojzA:
14.15
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.
1p49 STERYL-SULFATASE

(Homo sapiens) 		PF00884
(Sulfatase)
PF14707
(Sulfatase_C) 		4 ILE A 322
LEU A 323
TYR A 286
THR A 340
 None
 1.12A 6nmfN-1p49A:
undetectable
6nmfW-1p49A:
1.5		 6nmfN-1p49A:
23.37
6nmfW-1p49A:
5.91
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.
1pm2 RIBONUCLEOSIDE-DIPHO
SPHATE REDUCTASE 1
BETA CHAIN

(Escherichia
coli) 		PF00268
(Ribonuc_red_sm) 		5 ILE A 335
LEU A 339
TYR A 310
ARG A 328
THR A 312
 None
None
None
HG  A 614 ( 4.9A)
None
 1.44A 6nmfN-1pm2A:
undetectable
6nmfW-1pm2A:
undetectable		 6nmfN-1pm2A:
19.19
6nmfW-1pm2A:
11.21
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.
1r6x ATP:SULFATE
ADENYLYLTRANSFERASE

(Saccharomyces
cerevisiae) 		PF01747
(ATP-sulfurylase)
PF14306
(PUA_2) 		4 ILE A  48
LEU A  49
ARG A  40
THR A  38
 None
 1.01A 6nmfN-1r6xA:
undetectable
6nmfW-1r6xA:
undetectable		 6nmfN-1r6xA:
21.48
6nmfW-1r6xA:
11.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1rc9 CYSTEINE-RICH
SECRETORY PROTEIN

(Trimeresurus
stejnegeri) 		PF00188
(CAP)
PF08562
(Crisp) 		4 ILE A  90
LEU A  21
TYR A 147
THR A 117
 None
 1.02A 6nmfN-1rc9A:
undetectable
6nmfW-1rc9A:
undetectable		 6nmfN-1rc9A:
17.70
6nmfW-1rc9A:
11.01
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.
1tg5 4-HYDROXYPHENYLPYRUV
ATE DIOXYGENASE

(Arabidopsis
thaliana) 		PF00903
(Glyoxalase) 		4 ILE A 370
LEU A 364
ARG A 119
THR A  79
 None
 1.08A 6nmfN-1tg5A:
undetectable
6nmfW-1tg5A:
undetectable		 6nmfN-1tg5A:
21.26
6nmfW-1tg5A:
9.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1tnd TRANSDUCIN

(Bos taurus) 		PF00503
(G-alpha) 		4 ILE A  77
LEU A 152
MET A 115
THR A 114
 None
 1.09A 6nmfN-1tndA:
2.4
6nmfW-1tndA:
undetectable		 6nmfN-1tndA:
20.04
6nmfW-1tndA:
12.03
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.
1us8 DNA DOUBLE-STRAND
BREAK REPAIR RAD50
ATPASE

(Pyrococcus
furiosus) 		PF13476
(AAA_23) 		4 ILE A  84
LEU A  73
ARG A 102
THR A  80
 None
 0.96A 6nmfN-1us8A:
undetectable
6nmfW-1us8A:
undetectable		 6nmfN-1us8A:
14.25
6nmfW-1us8A:
22.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1w36 EXODEOXYRIBONUCLEASE
V GAMMA CHAIN

(Escherichia
coli) 		PF04257
(Exonuc_V_gamma) 		4 ILE C1105
LEU C1038
ARG C1068
THR C1069
 None
 1.14A 6nmfN-1w36C:
undetectable
6nmfW-1w36C:
undetectable		 6nmfN-1w36C:
17.92
6nmfW-1w36C:
4.92
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.
1wvr TRIFLIN

(Protobothrops
flavoviridis) 		PF00188
(CAP)
PF08562
(Crisp) 		4 ILE A  90
LEU A  21
TYR A 147
THR A 117
 None
 1.03A 6nmfN-1wvrA:
undetectable
6nmfW-1wvrA:
undetectable		 6nmfN-1wvrA:
15.85
6nmfW-1wvrA:
14.35
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.
1xio ANABAENA SENSORY
RHODOPSIN

(Nostoc sp. PCC
7120) 		PF01036
(Bac_rhodopsin) 		4 LEU A  84
TYR A 165
ARG A 151
THR A 170
 None
None
PEE  A 306 (-3.9A)
None
 1.14A 6nmfN-1xioA:
1.6
6nmfW-1xioA:
undetectable		 6nmfN-1xioA:
21.56
6nmfW-1xioA:
12.67
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.
1xx5 NATRIN 1

(Naja atra) 		PF00188
(CAP)
PF08562
(Crisp) 		4 ILE A  90
LEU A  21
TYR A 147
THR A 117
 None
 1.02A 6nmfN-1xx5A:
undetectable
6nmfW-1xx5A:
undetectable		 6nmfN-1xx5A:
16.47
6nmfW-1xx5A:
14.75
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.
1yax VIRULENCE SENSOR
PROTEIN PHOQ, SENSOR
DOMAIN

(Salmonella
enterica) 		PF08918
(PhoQ_Sensor) 		4 ILE A  88
LEU A  96
MET A 170
THR A 167
 None
 1.10A 6nmfN-1yaxA:
undetectable
6nmfW-1yaxA:
undetectable		 6nmfN-1yaxA:
14.62
6nmfW-1yaxA:
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.
1yrz XYLAN
BETA-1,4-XYLOSIDASE

(Bacillus
halodurans) 		PF04616
(Glyco_hydro_43) 		4 ILE A1428
LEU A1414
MET A1463
THR A1462
 None
 1.05A 6nmfN-1yrzA:
undetectable
6nmfW-1yrzA:
undetectable		 6nmfN-1yrzA:
20.25
6nmfW-1yrzA:
7.98
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.
2be7 ASPARTATE
CARBAMOYLTRANSFERASE
CATALYTIC CHAIN
ASPARTATE
CARBAMOYLTRANSFERASE
REGULATORY CHAIN

(Moritella
profunda;
Moritella
profunda) 		PF00185
(OTCace)
PF02729
(OTCace_N)
PF01948
(PyrI)
PF02748
(PyrI_C) 		4 ILE D 114
LEU A 115
ARG A 106
MET A 105
 None
 0.91A 6nmfN-2be7D:
undetectable
6nmfW-2be7D:
undetectable		 6nmfN-2be7D:
17.43
6nmfW-2be7D:
16.28
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.
2bfe 2-OXOISOVALERATE
DEHYDROGENASE ALPHA
SUBUNIT

(Homo sapiens) 		PF00676
(E1_dh) 		4 ILE A  73
LEU A  74
ARG A 338
THR A  65
 None
 1.07A 6nmfN-2bfeA:
undetectable
6nmfW-2bfeA:
undetectable		 6nmfN-2bfeA:
19.01
6nmfW-2bfeA:
9.18
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.
2c9k PESTICIDAL CRYSTAL
PROTEIN CRY4AA

(Bacillus
thuringiensis) 		PF00555
(Endotoxin_M)
PF03944
(Endotoxin_C)
PF03945
(Endotoxin_N) 		4 LEU A 205
TYR A  73
MET A 299
THR A 297
 None
 1.08A 6nmfN-2c9kA:
2.2
6nmfW-2c9kA:
undetectable		 6nmfN-2c9kA:
21.01
6nmfW-2c9kA:
7.50
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.
2d93 RAP GUANINE
NUCLEOTIDE EXCHANGE
FACTOR 6

(Homo sapiens) 		PF00027
(cNMP_binding) 		4 ILE A  11
LEU A  14
MET A  29
THR A  28
 None
 0.99A 6nmfN-2d93A:
undetectable
6nmfW-2d93A:
undetectable		 6nmfN-2d93A:
13.11
6nmfW-2d93A:
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.
2ipc PREPROTEIN
TRANSLOCASE SECA
SUBUNIT

(Thermus
thermophilus) 		PF01043
(SecA_PP_bind)
PF07516
(SecA_SW)
PF07517
(SecA_DEAD) 		4 ILE A 663
LEU A 678
ARG A 684
THR A 581
 None
 1.09A 6nmfN-2ipcA:
0.6
6nmfW-2ipcA:
undetectable		 6nmfN-2ipcA:
18.02
6nmfW-2ipcA:
4.55
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.
2izo FLAP
STRUCTURE-SPECIFIC
ENDONUCLEASE

(Sulfolobus
solfataricus) 		PF00752
(XPG_N)
PF00867
(XPG_I) 		4 ILE A 228
LEU A 229
ARG A 220
THR A 219
 None
 1.11A 6nmfN-2izoA:
undetectable
6nmfW-2izoA:
undetectable		 6nmfN-2izoA:
20.81
6nmfW-2izoA:
13.64
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.
2k0b SEQUESTOSOME-1

(Homo sapiens) 		PF16577
(UBA_5) 		4 ILE X  47
LEU X  44
ARG X  31
THR X  35
 None
 1.06A 6nmfN-2k0bX:
undetectable
6nmfW-2k0bX:
undetectable		 6nmfN-2k0bX:
7.69
6nmfW-2k0bX:
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.
2p4o HYPOTHETICAL PROTEIN

(Nostoc
punctiforme) 		no annotation 4 ILE A 213
LEU A 190
TYR A  11
THR A 244
 None
 0.96A 6nmfN-2p4oA:
undetectable
6nmfW-2p4oA:
undetectable		 6nmfN-2p4oA:
20.92
6nmfW-2p4oA:
12.82
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.
2qeq FLAVIVIRIN PROTEASE
NS3 CATALYTIC
SUBUNIT

(West Nile virus) 		PF00271
(Helicase_C)
PF07652
(Flavi_DEAD) 		4 ILE A 499
LEU A 496
ARG A 269
THR A 265
 None
 1.00A 6nmfN-2qeqA:
undetectable
6nmfW-2qeqA:
undetectable		 6nmfN-2qeqA:
21.49
6nmfW-2qeqA:
8.76
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.
2qne PUTATIVE
METHYLTRANSFERASE

(Desulfitobacterium
hafniense) 		PF06253
(MTTB) 		4 ILE A 225
LEU A 197
MET A  91
THR A 346
 None
EDO  A 478 ( 4.7A)
None
None
 1.14A 6nmfN-2qneA:
undetectable
6nmfW-2qneA:
undetectable		 6nmfN-2qneA:
21.42
6nmfW-2qneA:
9.77
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.
2uvd 3-OXOACYL-(ACYL-CARR
IER-PROTEIN)
REDUCTASE

(Bacillus
anthracis) 		PF13561
(adh_short_C2) 		4 ILE A 207
LEU A 204
MET A 191
THR A 189
 None
 0.97A 6nmfN-2uvdA:
undetectable
6nmfW-2uvdA:
undetectable		 6nmfN-2uvdA:
18.73
6nmfW-2uvdA:
12.93
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.
2waa XYLAN ESTERASE,
PUTATIVE, AXE2C

(Cellvibrio
japonicus) 		PF13472
(Lipase_GDSL_2) 		4 ILE A 233
LEU A 202
TYR A 248
THR A 253
 None
 1.15A 6nmfN-2waaA:
undetectable
6nmfW-2waaA:
undetectable		 6nmfN-2waaA:
19.62
6nmfW-2waaA:
10.26
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.
2yxe PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE

(Methanocaldococcus
jannaschii) 		PF01135
(PCMT) 		4 ILE A  11
LEU A  30
TYR A  90
THR A  95
 None
 1.02A 6nmfN-2yxeA:
2.4
6nmfW-2yxeA:
undetectable		 6nmfN-2yxeA:
17.67
6nmfW-2yxeA:
14.76
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.
2z67 O-PHOSPHOSERYL-TRNA(
SEC) SELENIUM
TRANSFERASE

(Methanococcus
maripaludis) 		PF05889
(SepSecS) 		4 ILE A 230
LEU A 219
ARG A 268
THR A 292
 None
 1.14A 6nmfN-2z67A:
undetectable
6nmfW-2z67A:
undetectable		 6nmfN-2z67A:
20.74
6nmfW-2z67A:
10.23
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.
2zsg AMINOPEPTIDASE P,
PUTATIVE

(Thermotoga
maritima) 		PF00557
(Peptidase_M24)
PF01321
(Creatinase_N) 		4 ILE A 230
ARG A 151
MET A 177
THR A 176
 None
 0.98A 6nmfN-2zsgA:
undetectable
6nmfW-2zsgA:
undetectable		 6nmfN-2zsgA:
20.79
6nmfW-2zsgA:
10.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3bq8 SENSOR PROTEIN PHOQ

(Escherichia
coli) 		PF08918
(PhoQ_Sensor) 		4 ILE A  88
LEU A  96
MET A 170
THR A 167
 None
 1.10A 6nmfN-3bq8A:
undetectable
6nmfW-3bq8A:
undetectable		 6nmfN-3bq8A:
14.63
6nmfW-3bq8A:
16.78
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.
3enp TP53RK-BINDING
PROTEIN

(Homo sapiens) 		PF08617
(CGI-121) 		4 ILE A 165
LEU A 162
MET A 140
THR A  46
 None
 0.94A 6nmfN-3enpA:
undetectable
6nmfW-3enpA:
undetectable		 6nmfN-3enpA:
16.92
6nmfW-3enpA:
15.06
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.
3ezx MONOMETHYLAMINE
CORRINOID PROTEIN 1

(Methanosarcina
barkeri) 		PF02310
(B12-binding)
PF02607
(B12-binding_2) 		4 ILE A  40
LEU A  37
ARG A 111
THR A 114
 None
 0.76A 6nmfN-3ezxA:
undetectable
6nmfW-3ezxA:
undetectable		 6nmfN-3ezxA:
18.16
6nmfW-3ezxA:
14.35
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.
3h90 FERROUS-IRON EFFLUX
PUMP FIEF

(Escherichia
coli) 		PF01545
(Cation_efflux)
PF16916
(ZT_dimer) 		4 ILE A  50
LEU A  25
TYR A 154
THR A  17
 None
 1.14A 6nmfN-3h90A:
1.8
6nmfW-3h90A:
undetectable		 6nmfN-3h90A:
19.46
6nmfW-3h90A:
12.23
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.
3hvm AGMATINE DEIMINASE

(Helicobacter
pylori) 		PF04371
(PAD_porph) 		4 ILE A  90
LEU A 181
MET A 135
THR A 134
 None
 1.05A 6nmfN-3hvmA:
undetectable
6nmfW-3hvmA:
undetectable		 6nmfN-3hvmA:
20.38
6nmfW-3hvmA:
9.83
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.
3k12 UNCHARACTERIZED
PROTEIN A6V7T0

(Pseudomonas
aeruginosa) 		PF01042
(Ribonuc_L-PSP) 		4 ILE A  49
LEU A  53
ARG A  95
THR A  94
 None
 1.11A 6nmfN-3k12A:
undetectable
6nmfW-3k12A:
undetectable		 6nmfN-3k12A:
12.99
6nmfW-3k12A:
20.34
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.
3k7d GLUTAMATE-AMMONIA-LI
GASE
ADENYLYLTRANSFERASE

(Escherichia
coli) 		PF03710
(GlnE)
PF08335
(GlnD_UR_UTase) 		4 ILE A 882
ARG A 808
MET A 811
THR A 812
 None
SO4  A   3 (-4.1A)
None
None
 1.09A 6nmfN-3k7dA:
undetectable
6nmfW-3k7dA:
undetectable		 6nmfN-3k7dA:
21.52
6nmfW-3k7dA:
7.47
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.
3mkz PROTEIN SOPB

(Escherichia
coli) 		no annotation 4 ILE A 179
LEU A 171
ARG A 195
THR A 199
 None
 1.08A 6nmfN-3mkzA:
undetectable
6nmfW-3mkzA:
undetectable		 6nmfN-3mkzA:
12.22
6nmfW-3mkzA:
18.75
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.
3oo3 OXY PROTEIN

(Actinoplanes
teichomyceticus) 		PF00067
(p450) 		4 ILE A 161
LEU A 157
ARG A 173
THR A 174
 None
 1.10A 6nmfN-3oo3A:
undetectable
6nmfW-3oo3A:
undetectable		 6nmfN-3oo3A:
21.86
6nmfW-3oo3A:
9.26
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.
3oum TOXOFLAVIN-DEGRADING
ENZYME

(Paenibacillus
polymyxa) 		PF00903
(Glyoxalase) 		4 ILE A  63
LEU A 114
TYR A  21
MET A  24
 None
 1.07A 6nmfN-3oumA:
undetectable
6nmfW-3oumA:
undetectable		 6nmfN-3oumA:
18.22
6nmfW-3oumA:
12.55
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.
3poa PUTATIVE
UNCHARACTERIZED
PROTEIN TB39.8

(Mycobacterium
tuberculosis) 		PF00498
(FHA) 		4 ILE A  85
LEU A  87
ARG A  95
THR A  17
 None
 1.00A 6nmfN-3poaA:
undetectable
6nmfW-3poaA:
undetectable		 6nmfN-3poaA:
10.83
6nmfW-3poaA:
14.42
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.
3w1e FLAGELLA BASAL-BODY
PROTEIN

(Vibrio
alginolyticus) 		PF16538
(FlgT_C)
PF16539
(FlgT_M)
PF16548
(FlgT_N) 		4 ILE A 266
LEU A 268
TYR A 170
THR A 208
 None
 1.10A 6nmfN-3w1eA:
undetectable
6nmfW-3w1eA:
undetectable		 6nmfN-3w1eA:
21.00
6nmfW-3w1eA:
9.91
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.
3w7b FORMYLTETRAHYDROFOLA
TE DEFORMYLASE

(Thermus
thermophilus) 		PF00551
(Formyl_trans_N)
PF01842
(ACT) 		4 ILE A  93
LEU A 105
ARG A 119
MET A 116
 None
 1.03A 6nmfN-3w7bA:
undetectable
6nmfW-3w7bA:
undetectable		 6nmfN-3w7bA:
18.86
6nmfW-3w7bA:
9.82
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.
3wau 4-O-BETA-D-MANNOSYL-
D-GLUCOSE
PHOSPHORYLASE

(Bacteroides
fragilis) 		PF04041
(Glyco_hydro_130) 		4 ILE A 354
LEU A 357
MET A 290
THR A 291
 None
 1.14A 6nmfN-3wauA:
undetectable
6nmfW-3wauA:
undetectable		 6nmfN-3wauA:
22.67
6nmfW-3wauA:
9.82
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.
3wzf ASPARTATE
AMINOTRANSFERASE,
CYTOPLASMIC

(Homo sapiens) 		PF00155
(Aminotran_1_2) 		4 ILE A 387
LEU A 381
ARG A 340
THR A 402
 None
 0.79A 6nmfN-3wzfA:
undetectable
6nmfW-3wzfA:
undetectable		 6nmfN-3wzfA:
20.90
6nmfW-3wzfA:
9.27
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.
4a5w COMPLEMENT C5

(Homo sapiens) 		PF00207
(A2M)
PF01759
(NTR)
PF01835
(A2M_N)
PF07677
(A2M_recep)
PF07678
(A2M_comp)
PF07703
(A2M_N_2) 		4 ILE A1461
LEU A1462
TYR A1496
THR A1506
 None
 1.05A 6nmfN-4a5wA:
undetectable
6nmfW-4a5wA:
undetectable		 6nmfN-4a5wA:
15.08
6nmfW-4a5wA:
3.59
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.
4f53 SUSD HOMOLOG

(Bacteroides
ovatus) 		PF12741
(SusD-like) 		4 ILE A 451
LEU A 447
ARG A 223
MET A 226
 None
 1.04A 6nmfN-4f53A:
0.4
6nmfW-4f53A:
undetectable		 6nmfN-4f53A:
19.76
6nmfW-4f53A:
7.38
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.
4f92 U5 SMALL NUCLEAR
RIBONUCLEOPROTEIN
200 KDA HELICASE

(Homo sapiens) 		PF00270
(DEAD)
PF00271
(Helicase_C)
PF02889
(Sec63) 		4 ILE B 828
LEU B 869
ARG B 855
THR B 505
 None
 1.05A 6nmfN-4f92B:
undetectable
6nmfW-4f92B:
undetectable		 6nmfN-4f92B:
14.26
6nmfW-4f92B:
3.00
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.
4i5s PUTATIVE HISTIDINE
KINASE COVS
VICK-LIKE PROTEIN

(Streptococcus
mutans) 		PF00512
(HisKA)
PF00989
(PAS)
PF02518
(HATPase_c) 		4 ILE A 321
LEU A 360
MET A 328
THR A 329
 None
 1.01A 6nmfN-4i5sA:
1.0
6nmfW-4i5sA:
undetectable		 6nmfN-4i5sA:
20.74
6nmfW-4i5sA:
8.31
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.
4iws PA0254

(Pseudomonas
aeruginosa) 		PF01977
(UbiD) 		4 ILE A 259
LEU A 209
ARG A 133
THR A 132
 None
 1.14A 6nmfN-4iwsA:
undetectable
6nmfW-4iwsA:
undetectable		 6nmfN-4iwsA:
21.72
6nmfW-4iwsA:
6.95
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.
4kvl FATTY ACID
ALPHA-OXIDASE

(Oryza sativa) 		PF03098
(An_peroxidase) 		4 ILE A 427
LEU A 424
ARG A 392
MET A 436
 None
 1.13A 6nmfN-4kvlA:
undetectable
6nmfW-4kvlA:
undetectable		 6nmfN-4kvlA:
22.90
6nmfW-4kvlA:
8.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4mru SUSD HOMOLOG

(Bacteroides
thetaiotaomicron) 		PF12741
(SusD-like) 		4 ILE A 439
LEU A 435
ARG A 228
MET A 231
 None
None
EDO  A 604 (-3.1A)
None
 1.04A 6nmfN-4mruA:
0.4
6nmfW-4mruA:
undetectable		 6nmfN-4mruA:
19.65
6nmfW-4mruA:
8.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4mwa 4-HYDROXY-3-METHYLBU
T-2-EN-1-YL
DIPHOSPHATE SYNTHASE

(Bacillus
anthracis) 		PF04551
(GcpE) 		4 ILE D 163
LEU D 160
ARG D 131
MET D 178
 None
 1.01A 6nmfN-4mwaD:
undetectable
6nmfW-4mwaD:
undetectable		 6nmfN-4mwaD:
21.17
6nmfW-4mwaD:
11.91
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.
4nek ENOYL-COA
HYDRATASE/CARNITHINE
RACEMASE

(Magnetospirillum
magneticum) 		PF00378
(ECH_1) 		4 ILE A 105
LEU A 109
ARG A  20
MET A  18
 None
 0.94A 6nmfN-4nekA:
undetectable
6nmfW-4nekA:
undetectable		 6nmfN-4nekA:
19.65
6nmfW-4nekA:
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.
4nob POLYMERIC
IMMUNOGLOBULIN
RECEPTOR

(Mus musculus) 		PF07686
(V-set) 		4 ILE A  95
LEU A  84
ARG A  57
THR A  65
 None
None
EDO  A 204 (-4.0A)
None
 0.73A 6nmfN-4nobA:
undetectable
6nmfW-4nobA:
undetectable		 6nmfN-4nobA:
12.43
6nmfW-4nobA:
19.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4r40 PROTEIN TOLB

(Yersinia pestis) 		PF04052
(TolB_N)
PF07676
(PD40) 		4 ILE A  25
LEU A 414
MET A 388
THR A 387
 None
 1.02A 6nmfN-4r40A:
undetectable
6nmfW-4r40A:
undetectable		 6nmfN-4r40A:
22.91
6nmfW-4r40A:
8.31
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.
4rh7 GREEN FLUORESCENT
PROTEIN/CYTOPLASMIC
DYNEIN 2 HEAVY CHAIN
1

(Homo sapiens;
synthetic
construct) 		PF03028
(Dynein_heavy)
PF07728
(AAA_5)
PF08393
(DHC_N2)
PF12774
(AAA_6)
PF12775
(AAA_7)
PF12777
(MT)
PF12780
(AAA_8)
PF12781
(AAA_9) 		4 ILE A2627
LEU A2628
MET A2873
THR A2874
 ADP  A4406 (-4.0A)
ADP  A4406 (-3.8A)
ADP  A4406 (-4.5A)
None
 0.89A 6nmfN-4rh7A:
undetectable
6nmfW-4rh7A:
undetectable		 6nmfN-4rh7A:
9.49
6nmfW-4rh7A:
3.11
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.
4rkc AROMATIC AMINO ACID
AMINOTRANSFERASE

(Psychrobacter
sp. B6) 		PF00155
(Aminotran_1_2) 		4 ILE A 367
LEU A  31
ARG A 360
THR A 354
 None
 1.08A 6nmfN-4rkcA:
undetectable
6nmfW-4rkcA:
undetectable		 6nmfN-4rkcA:
21.47
6nmfW-4rkcA:
9.57
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.
4u1r ATP-DEPENDENT
6-PHOSPHOFRUCTOKINAS
E, PLATELET TYPE

(Homo sapiens) 		PF00365
(PFK) 		4 ILE A 476
LEU A 477
ARG A 683
THR A 687
 None
 0.90A 6nmfN-4u1rA:
undetectable
6nmfW-4u1rA:
undetectable		 6nmfN-4u1rA:
21.55
6nmfW-4u1rA:
6.75
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.
4x0g BLASTODERM-SPECIFIC
GENE 25A

(Drosophila
melanogaster) 		PF10523
(BEN) 		4 ILE A  39
LEU A  36
MET A  81
THR A  82
 None
 1.11A 6nmfN-4x0gA:
undetectable
6nmfW-4x0gA:
undetectable		 6nmfN-4x0gA:
11.39
6nmfW-4x0gA:
18.35
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.
4xgc ORIGIN RECOGNITION
COMPLEX SUBUNIT 4

(Drosophila
melanogaster) 		PF13191
(AAA_16)
PF14629
(ORC4_C) 		4 ILE D 143
LEU D 178
TYR D 250
THR D  24
 None
 1.04A 6nmfN-4xgcD:
undetectable
6nmfW-4xgcD:
undetectable		 6nmfN-4xgcD:
21.64
6nmfW-4xgcD:
9.59
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.
5bp1 MYCOCEROSIC ACID
SYNTHASE

(Mycolicibacterium
smegmatis) 		PF00109
(ketoacyl-synt)
PF00698
(Acyl_transf_1)
PF02801
(Ketoacyl-synt_C)
PF16197
(KAsynt_C_assoc) 		4 ILE A 267
LEU A 426
ARG A 190
THR A 272
 None
 0.83A 6nmfN-5bp1A:
undetectable
6nmfW-5bp1A:
undetectable		 6nmfN-5bp1A:
19.82
6nmfW-5bp1A:
5.04
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.
5ce0 NATIVE CONSERPIN
WITH Z-VARIANT
(E342K)

(synthetic
construct) 		PF00079
(Serpin) 		4 ILE A 225
LEU A 341
ARG A 345
THR A   9
 None
 1.00A 6nmfN-5ce0A:
undetectable
6nmfW-5ce0A:
undetectable		 6nmfN-5ce0A:
20.49
6nmfW-5ce0A:
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.
5ehk LANTIBIOTIC
DEHYDRATASE

(Microbispora
corallina) 		PF04738
(Lant_dehydr_N)
PF14028
(Lant_dehydr_C) 		4 ILE A 373
LEU A 375
ARG A 136
THR A 139
 None
 1.12A 6nmfN-5ehkA:
undetectable
6nmfW-5ehkA:
undetectable		 6nmfN-5ehkA:
17.65
6nmfW-5ehkA:
3.87
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.
5es2 UNCHARACTERIZED
PROTEIN LPG0634

(Legionella
pneumophila) 		PF16848
(SoDot-IcmSS) 		4 ILE A 136
LEU A 146
ARG A 381
THR A 382
 None
 1.03A 6nmfN-5es2A:
2.0
6nmfW-5es2A:
undetectable		 6nmfN-5es2A:
20.68
6nmfW-5es2A:
8.65
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.
5f15 4-AMINO-4-DEOXY-L-AR
ABINOSE (L-ARA4N)
TRANSFERASE

(Cupriavidus
metallidurans) 		PF13231
(PMT_2) 		4 ILE A 119
LEU A 142
MET A 159
THR A 160
 MPG  A 602 ( 4.5A)
None
None
None
 1.00A 6nmfN-5f15A:
2.5
6nmfW-5f15A:
undetectable		 6nmfN-5f15A:
23.90
6nmfW-5f15A:
6.64
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.
5f59 HISTONE-LYSINE
N-METHYLTRANSFERASE
2C

(Homo sapiens) 		PF00856
(SET) 		4 ILE A4801
TYR A4762
MET A4765
THR A4767
 None
 0.88A 6nmfN-5f59A:
undetectable
6nmfW-5f59A:
undetectable		 6nmfN-5f59A:
13.20
6nmfW-5f59A:
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.
5gk2 KETOSYNTHASE STLD

(Photorhabdus
laumondii) 		PF08541
(ACP_syn_III_C) 		4 ILE A  48
TYR A  53
MET A  24
THR A  23
 None
 1.08A 6nmfN-5gk2A:
undetectable
6nmfW-5gk2A:
undetectable		 6nmfN-5gk2A:
19.85
6nmfW-5gk2A:
8.50
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.
5h9f CRISPR SYSTEM
CASCADE SUBUNIT CASC

(Escherichia
coli) 		PF09344
(Cas_CT1975) 		4 ILE D 160
LEU D 154
MET D 172
THR D 173
 None
 1.10A 6nmfN-5h9fD:
undetectable
6nmfW-5h9fD:
undetectable		 6nmfN-5h9fD:
21.55
6nmfW-5h9fD:
12.17
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.
5i5h INNER MEMBRANE
PROTEIN YEJM

(Escherichia
coli) 		PF00884
(Sulfatase)
PF11893
(DUF3413) 		4 ILE A 446
LEU A 264
ARG A 501
THR A 496
 None
 1.06A 6nmfN-5i5hA:
undetectable
6nmfW-5i5hA:
undetectable		 6nmfN-5i5hA:
21.92
6nmfW-5i5hA:
8.62
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.
5ica PUTATIVE U3 SNORNP
PROTEIN

(Chaetomium
thermophilum) 		PF04192
(Utp21) 		4 ILE C1006
LEU C 971
MET C 995
THR C 996
 None
 1.13A 6nmfN-5icaC:
undetectable
6nmfW-5icaC:
undetectable		 6nmfN-5icaC:
18.55
6nmfW-5icaC:
14.46
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.
5jrl DIPEPTIDYL
AMINOPEPTIDASES/ACYL
AMINOACYL-PEPTIDASES
-LIKE PROTEIN

(Sphingopyxis
alaskensis) 		PF00326
(Peptidase_S9) 		4 ILE A 159
LEU A 118
ARG A 219
THR A 218
 None
 1.14A 6nmfN-5jrlA:
undetectable
6nmfW-5jrlA:
undetectable		 6nmfN-5jrlA:
20.65
6nmfW-5jrlA:
5.69
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.
5mwl INOSITOL-PENTAKISPHO
SPHATE 2-KINASE

(Mus musculus) 		PF06090
(Ins_P5_2-kin) 		4 LEU A 452
ARG A 393
MET A 396
THR A 397
 5MY  A 502 (-4.6A)
None
None
None
 1.06A 6nmfN-5mwlA:
undetectable
6nmfW-5mwlA:
undetectable		 6nmfN-5mwlA:
19.60
6nmfW-5mwlA:
8.96
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.
5mwl INOSITOL-PENTAKISPHO
SPHATE 2-KINASE

(Mus musculus) 		PF06090
(Ins_P5_2-kin) 		4 LEU A 452
TYR A 392
MET A 396
THR A 397
 5MY  A 502 (-4.6A)
None
None
None
 0.84A 6nmfN-5mwlA:
undetectable
6nmfW-5mwlA:
undetectable		 6nmfN-5mwlA:
19.60
6nmfW-5mwlA:
8.96
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.
5nqd ARSENITE OXIDASE
LARGE SUBUNIT AIOA
[3FE-4S] CLUSTER,
MO-MOLYBDOPTERIN
COFACTOR-BINDING
ACTIVE SITE

(Rhizobium sp.
NT-26) 		no annotation 4 LEU A 163
ARG A 149
MET A 604
THR A 603
 None
 1.00A 6nmfN-5nqdA:
undetectable
6nmfW-5nqdA:
undetectable		 6nmfN-5nqdA:
undetectable
6nmfW-5nqdA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5nzg UDP-GLUCOSE
PYROPHOSPHORYLASE

(Leishmania
major) 		no annotation 4 ILE A 194
LEU A 198
MET A 321
THR A 320
 None
 1.13A 6nmfN-5nzgA:
undetectable
6nmfW-5nzgA:
undetectable		 6nmfN-5nzgA:
undetectable
6nmfW-5nzgA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5tro PENICILLIN-BINDING
PROTEIN 1

(Staphylococcus
aureus) 		PF00905
(Transpeptidase)
PF03717
(PBP_dimer) 		4 ILE A 124
LEU A 113
ARG A 140
THR A 143
 None
 1.14A 6nmfN-5troA:
undetectable
6nmfW-5troA:
undetectable		 6nmfN-5troA:
21.23
6nmfW-5troA:
7.94
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.
5u7z ACID CERAMIDASE

(Homo sapiens) 		no annotation 4 ILE B 249
LEU B 252
TYR B 207
THR B 212
 None
 1.03A 6nmfN-5u7zB:
undetectable
6nmfW-5u7zB:
undetectable		 6nmfN-5u7zB:
undetectable
6nmfW-5u7zB:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5v1w GLYCOSIDE HYDROLASE

(Bacillus
halodurans) 		PF03639
(Glyco_hydro_81) 		4 ILE A 734
LEU A 355
TYR A 351
THR A 729
 None
 1.11A 6nmfN-5v1wA:
undetectable
6nmfW-5v1wA:
undetectable		 6nmfN-5v1wA:
21.86
6nmfW-5v1wA:
6.00
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.
5vgc NLEG5-1 EFFECTOR

(Enterobacteria
phage YYZ-2008) 		no annotation 4 ILE A  27
LEU A  24
ARG A  39
THR A   6
 None
 0.81A 6nmfN-5vgcA:
undetectable
6nmfW-5vgcA:
undetectable		 6nmfN-5vgcA:
undetectable
6nmfW-5vgcA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5xcy GLUCANASE

(Phanerochaete
chrysosporium) 		PF01341
(Glyco_hydro_6) 		4 ILE A 213
LEU A 245
TYR A 190
THR A 236
 None
 1.06A 6nmfN-5xcyA:
undetectable
6nmfW-5xcyA:
undetectable		 6nmfN-5xcyA:
19.62
6nmfW-5xcyA:
10.00
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.
5xhu FERREDOXIN--NADP
REDUCTASE

(Bacillus
subtilis) 		no annotation 4 ILE A 223
LEU A 216
ARG A 157
THR A 182
 None
 1.13A 6nmfN-5xhuA:
undetectable
6nmfW-5xhuA:
undetectable		 6nmfN-5xhuA:
undetectable
6nmfW-5xhuA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5xyn PLATINUM SENSITIVITY
PROTEIN 3

(Saccharomyces
cerevisiae) 		no annotation 4 ILE A 135
LEU A 138
ARG A 168
MET A 219
 None
 1.14A 6nmfN-5xynA:
undetectable
6nmfW-5xynA:
undetectable		 6nmfN-5xynA:
20.47
6nmfW-5xynA:
17.30
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.
5ydp TETR TRANSCRIPTIONAL
REGULATORY PROTEIN

(Dietzia sp.
DQ12-45-1b) 		PF00440
(TetR_N) 		4 ILE A 205
LEU A 108
ARG A 181
THR A 153
 None
 1.13A 6nmfN-5ydpA:
undetectable
6nmfW-5ydpA:
undetectable		 6nmfN-5ydpA:
18.45
6nmfW-5ydpA:
14.69
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.
5z9a CHORISMATE SYNTHASE

(Pseudomonas
aeruginosa) 		no annotation 4 ILE A 206
LEU A 289
ARG A 326
THR A 131
 None
 1.02A 6nmfN-5z9aA:
undetectable
6nmfW-5z9aA:
undetectable		 6nmfN-5z9aA:
undetectable
6nmfW-5z9aA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6b5i RETINAL
DEHYDROGENASE 2

(Homo sapiens) 		no annotation 4 ILE A 157
LEU A 500
ARG A  95
THR A 206
 None
 1.13A 6nmfN-6b5iA:
undetectable
6nmfW-6b5iA:
undetectable		 6nmfN-6b5iA:
undetectable
6nmfW-6b5iA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6b5v TRANSIENT RECEPTOR
POTENTIAL CATION
CHANNEL SUBFAMILY V
MEMBER 5

(Oryctolagus
cuniculus) 		no annotation 4 ILE A 183
LEU A 182
ARG A 190
THR A 198
 None
 0.85A 6nmfN-6b5vA:
undetectable
6nmfW-6b5vA:
undetectable		 6nmfN-6b5vA:
undetectable
6nmfW-6b5vA:
undetectable