SIMILAR PATTERNS OF AMINO ACIDS FOR 2DCF_A_ACAA502_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.
1a40 PHOSPHATE-BINDING
PERIPLASMIC PROTEIN
PRECURSOR

(Escherichia
coli) 		PF12849
(PBP_like_2) 		5 ALA A  54
VAL A 273
PHE A  72
GLY A  41
ILE A  45
 None
 1.25A 2dcfA-1a40A:
0.0		 2dcfA-1a40A:
24.21
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.
1a40 PHOSPHATE-BINDING
PERIPLASMIC PROTEIN
PRECURSOR

(Escherichia
coli) 		PF12849
(PBP_like_2) 		5 ALA A  54
VAL A 273
TYR A  33
PHE A  72
GLY A  41
 None
 0.98A 2dcfA-1a40A:
0.0		 2dcfA-1a40A:
24.21
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.
1c30 CARBAMOYL PHOSPHATE
SYNTHETASE: LARGE
SUBUNIT

(Escherichia
coli) 		PF02142
(MGS)
PF02786
(CPSase_L_D2)
PF02787
(CPSase_L_D3) 		5 MET A 240
ALA A 239
SER A 247
ASN A 236
GLY A 212
 ADP  A4000 (-4.0A)
None
K  A4003 (-2.7A)
K  A4003 (-3.9A)
None
 1.42A 2dcfA-1c30A:
0.0		 2dcfA-1c30A:
16.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1c4x PROTEIN
(2-HYDROXY-6-OXO-6-P
HENYLHEXA-2,4-DIENOA
TE HYDROLASE)

(Rhodococcus
jostii) 		PF12697
(Abhydrolase_6) 		5 VAL A 238
ASP A 235
SER A 110
ASN A 109
GLY A  38
 None
 1.18A 2dcfA-1c4xA:
0.0		 2dcfA-1c4xA:
22.06
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.
1d6s O-ACETYLSERINE
SULFHYDRYLASE

(Salmonella
enterica) 		PF00291
(PALP) 		5 ALA A  75
SER A  39
ASN A  71
GLY A  45
ILE A  44
 None
None
PLP  A 501 ( 3.9A)
None
None
 1.10A 2dcfA-1d6sA:
undetectable		 2dcfA-1d6sA:
22.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1hl2 N-ACETYLNEURAMINATE
LYASE SUBUNIT

(Escherichia
coli) 		PF00701
(DHDPS) 		5 TYR A 187
VAL A 185
ASP A 203
ASN A   4
GLY A  41
 None
 1.18A 2dcfA-1hl2A:
0.0		 2dcfA-1hl2A:
23.97
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.
1lxy ARGININE DEIMINASE

(Mycoplasma
arginini) 		PF02274
(Amidinotransf) 		5 ALA A 396
VAL A  23
SER A 400
GLY A 363
ILE A 362
 None
 1.20A 2dcfA-1lxyA:
0.0		 2dcfA-1lxyA:
21.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1pgu ACTIN INTERACTING
PROTEIN 1

(Saccharomyces
cerevisiae) 		PF00400
(WD40) 		5 VAL A 212
TYR A 188
SER A 176
GLY A 142
ILE A 163
 None
 1.34A 2dcfA-1pguA:
0.0		 2dcfA-1pguA:
20.61
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.
1r9j TRANSKETOLASE

(Leishmania
mexicana) 		PF00456
(Transketolase_N)
PF02779
(Transket_pyr)
PF02780
(Transketolase_C) 		5 MET A 622
TYR A 635
SER A 461
GLY A 621
ILE A 640
 None
 1.19A 2dcfA-1r9jA:
0.0		 2dcfA-1r9jA:
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.
1sgm PUTATIVE HTH-TYPE
TRANSCRIPTIONAL
REGULATOR YXAF

(Bacillus
subtilis) 		PF00440
(TetR_N) 		5 VAL A  66
PHE A 128
ASN A 157
GLY A 163
ILE A 164
 None
 1.19A 2dcfA-1sgmA:
0.0		 2dcfA-1sgmA:
17.85
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.
1woy METHIONYL-TRNA
SYNTHETASE

(Thermus
thermophilus) 		PF00133
(tRNA-synt_1)
PF09334
(tRNA-synt_1g) 		5 ALA A 276
TYR A 240
VAL A 103
GLY A 277
ILE A 278
 None
 1.21A 2dcfA-1woyA:
undetectable		 2dcfA-1woyA:
22.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1xc3 PUTATIVE
FRUCTOKINASE

(Bacillus
subtilis) 		PF00480
(ROK) 		5 ALA A 106
VAL A  61
SER A 101
ASN A 105
GLY A 276
 None
 1.40A 2dcfA-1xc3A:
undetectable		 2dcfA-1xc3A:
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.
1ydo HMG-COA LYASE

(Bacillus
subtilis) 		PF00682
(HMGL-like) 		5 ALA A 183
VAL A 154
ASP A 153
GLY A 181
ILE A 180
 None
 1.15A 2dcfA-1ydoA:
undetectable		 2dcfA-1ydoA:
22.28
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.
2c5q RRAA-LIKE PROTEIN
YER010C

(Saccharomyces
cerevisiae) 		PF03737
(RraA-like) 		5 ALA A 107
TYR A  66
VAL A  52
TYR A  99
ILE A  67
 None
 0.99A 2dcfA-2c5qA:
undetectable		 2dcfA-2c5qA:
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.
2d5m FLAVOREDOXIN

(Desulfovibrio
vulgaris) 		PF01613
(Flavin_Reduct) 		5 ALA A  32
TYR A 171
VAL A 162
PHE A 114
GLY A  83
 FMN  A1001 (-3.8A)
None
None
None
FMN  A1001 (-3.2A)
 1.42A 2dcfA-2d5mA:
undetectable		 2dcfA-2d5mA:
19.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2f4n HYPOTHETICAL PROTEIN
MJ1651

(Methanocaldococcus
jannaschii) 		PF01887
(SAM_adeno_trans) 		5 ALA A  64
VAL A 166
ASP A 108
GLY A  63
ILE A  60
 None
 1.29A 2dcfA-2f4nA:
undetectable		 2dcfA-2f4nA:
19.61
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.
2fcf MULTIPLE PDZ DOMAIN
PROTEIN

(Homo sapiens) 		PF00595
(PDZ) 		5 ALA A1196
VAL A1239
ASN A1199
GLY A1163
ILE A1164
 None
 1.18A 2dcfA-2fcfA:
undetectable		 2dcfA-2fcfA:
14.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ipi ACLACINOMYCIN
OXIDOREDUCTASE
(AKNOX)

(Streptomyces
galilaeus) 		PF01565
(FAD_binding_4)
PF08031
(BBE) 		5 MET A  57
ALA A  56
VAL A 164
ASN A  54
ILE A  63
 None
 1.41A 2dcfA-2ipiA:
undetectable		 2dcfA-2ipiA:
22.74
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.
2o1x 1-DEOXY-D-XYLULOSE-5
-PHOSPHATE SYNTHASE

(Deinococcus
radiodurans) 		PF02779
(Transket_pyr)
PF02780
(Transketolase_C)
PF13292
(DXP_synthase_N) 		5 MET A 161
ALA A 162
VAL A 122
SER A 128
GLY A 159
 None
 1.34A 2dcfA-2o1xA:
undetectable		 2dcfA-2o1xA:
22.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2paj PUTATIVE
CYTOSINE/GUANINE
DEAMINASE

(unidentified) 		PF01979
(Amidohydro_1) 		5 ALA A 119
VAL A 474
PHE A 110
GLY A 122
ILE A 121
 None
 1.40A 2dcfA-2pajA:
undetectable		 2dcfA-2pajA:
22.56
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.
2v9i RHAMNULOSE-1-PHOSPHA
TE ALDOLASE

(Escherichia
coli) 		PF00596
(Aldolase_II) 		5 MET A 140
ASP A  26
ASN A  32
GLY A 216
ILE A 228
 None
 1.42A 2dcfA-2v9iA:
undetectable		 2dcfA-2v9iA:
20.45
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.
2vpw HYPOTHETICAL
MEMBRANE SPANNING
PROTEIN

(Thermus
thermophilus) 		PF14589
(NrfD_2) 		5 TYR C 130
VAL C  25
ASP C  60
ASN C  18
ILE C  89
 MQ7  C1252 (-4.4A)
None
None
MQ7  C1252 (-3.1A)
MQ7  C1252 (-3.8A)
 1.43A 2dcfA-2vpwC:
undetectable		 2dcfA-2vpwC:
22.31
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.
2vrf BETA-2-SYNTROPHIN

(Homo sapiens) 		PF00595
(PDZ) 		5 ALA A 150
VAL A 116
SER A 154
GLY A 127
ILE A 128
 None
 1.41A 2dcfA-2vrfA:
undetectable		 2dcfA-2vrfA:
11.60
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.
2w6d DYNAMIN FAMILY
PROTEIN

(Nostoc
punctiforme) 		PF00350
(Dynamin_N) 		5 ALA A  88
VAL A  74
ASP A 180
GLY A  91
ILE A  90
 None
 1.25A 2dcfA-2w6dA:
undetectable		 2dcfA-2w6dA:
20.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2wk8 CAI-1 AUTOINDUCER
SYNTHASE

(Vibrio cholerae) 		PF00155
(Aminotran_1_2) 		5 ALA A 111
ASP A 173
SER A 135
ASN A 112
GLY A 243
 None
PLP  A 600 (-3.5A)
PLP  A 600 ( 3.8A)
PLP  A 600 ( 4.7A)
None
 1.34A 2dcfA-2wk8A:
undetectable		 2dcfA-2wk8A:
22.67
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.
2zbk TYPE 2 DNA
TOPOISOMERASE 6
SUBUNIT B

(Sulfolobus
shibatae) 		PF02518
(HATPase_c)
PF09239
(Topo-VIb_trans) 		5 MET B 412
ALA B 354
VAL B 316
GLY B 355
ILE B 322
 None
 1.28A 2dcfA-2zbkB:
undetectable		 2dcfA-2zbkB:
22.59
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2zm2 6-AMINOHEXANOATE-DIM
ER HYDROLASE

(Flavobacterium
sp.) 		PF00144
(Beta-lactamase) 		7 MET A 111
VAL A 177
TRP A 186
TYR A 215
SER A 217
GLY A 344
ILE A 345
 MES  A 504 (-3.8A)
MES  A 504 (-4.4A)
MES  A 504 (-4.0A)
GOL  A 505 ( 4.4A)
MES  A 504 ( 2.7A)
MES  A 501 (-3.5A)
MES  A 504 ( 3.7A)
 0.46A 2dcfA-2zm2A:
67.4		 2dcfA-2zm2A:
97.45
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.
3c8l FTSZ-LIKE PROTEIN OF
UNKNOWN FUNCTION

(Nostoc
punctiforme) 		PF09585
(Lin0512_fam) 		5 MET A  12
ALA A 110
VAL A  92
GLY A  13
ILE A  14
 None
None
None
CL  A 124 ( 3.7A)
CL  A 124 (-4.4A)
 1.30A 2dcfA-3c8lA:
undetectable		 2dcfA-3c8lA:
16.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ce6 ADENOSYLHOMOCYSTEINA
SE

(Mycobacterium
tuberculosis) 		PF00670
(AdoHcyase_NAD)
PF05221
(AdoHcyase) 		5 MET A 352
ALA A 351
PHE A 392
GLY A 329
ILE A 328
 None
 1.33A 2dcfA-3ce6A:
undetectable		 2dcfA-3ce6A:
23.84
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.
3cih PUTATIVE
ALPHA-RHAMNOSIDASE

(Bacteroides
thetaiotaomicron) 		PF17389
(Bac_rhamnosid6H)
PF17390
(Bac_rhamnosid_C) 		5 MET A 322
TYR A 300
PHE A 330
GLY A 318
ILE A 629
 None
 1.38A 2dcfA-3cihA:
undetectable		 2dcfA-3cihA:
18.15
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.
3cty THIOREDOXIN
REDUCTASE

(Thermoplasma
acidophilum) 		PF07992
(Pyr_redox_2) 		5 TYR A 207
VAL A 197
ASN A 165
GLY A 162
ILE A 183
 None
 1.40A 2dcfA-3ctyA:
undetectable		 2dcfA-3ctyA:
21.70
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.
3cyg UNCHARACTERIZED
PROTEIN

(Fervidobacterium
nodosum) 		PF11738
(DUF3298)
PF13739
(DUF4163) 		5 VAL A 125
SER A 123
ASN A 145
GLY A 207
ILE A 209
 None
 1.06A 2dcfA-3cygA:
undetectable		 2dcfA-3cygA:
17.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3d54 PHOSPHORIBOSYLFORMYL
GLYCINAMIDINE
SYNTHASE 1

(Thermotoga
maritima) 		PF13507
(GATase_5) 		5 MET D 184
ALA D 171
SER D 166
ASN D 164
GLY D 172
 CYG  D  86 ( 3.4A)
None
None
None
None
 1.38A 2dcfA-3d54D:
undetectable		 2dcfA-3d54D:
20.15
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.
3du4 ADENOSYLMETHIONINE-8
-AMINO-7-OXONONANOAT
E AMINOTRANSFERASE

(Bacillus
subtilis) 		PF00202
(Aminotran_3) 		5 ALA A 328
TYR A 109
VAL A 107
GLY A 324
ILE A 289
 None
 1.36A 2dcfA-3du4A:
undetectable		 2dcfA-3du4A:
22.11
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.
3ehs FUSION PROTEIN OF
CRFR1 EXTRACELLULAR
DOMAIN AND MBP

(Escherichia
coli;
Homo sapiens) 		PF02793
(HRM)
PF13416
(SBP_bac_8) 		5 ALA A-118
ASP A -53
TYR A-139
ASN A-115
GLY A-121
 None
 1.29A 2dcfA-3ehsA:
undetectable		 2dcfA-3ehsA:
21.11
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.
3fcp L-ALA-D/L-GLU
EPIMERASE, A
MUCONATE LACTONIZING
ENZYME

(Klebsiella
pneumoniae) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 ALA A 294
TYR A 271
VAL A 253
GLY A 295
ILE A 296
 None
 1.37A 2dcfA-3fcpA:
undetectable		 2dcfA-3fcpA:
21.75
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.
3fg9 PROTEIN OF UNIVERSAL
STRESS PROTEIN USPA
FAMILY

(Lactobacillus
plantarum) 		PF00582
(Usp) 		5 TYR A  81
VAL A  19
ASP A  20
SER A  27
ASN A  24
 None
None
FMT  A 155 ( 4.9A)
None
FMT  A 155 (-4.4A)
 1.39A 2dcfA-3fg9A:
undetectable		 2dcfA-3fg9A:
17.86
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.
3fvr ACETYL XYLAN
ESTERASE

(Bacillus
pumilus) 		PF05448
(AXE1) 		5 TYR A  49
VAL A  51
ASN A 104
GLY A  98
ILE A  99
 None
 1.34A 2dcfA-3fvrA:
undetectable		 2dcfA-3fvrA:
22.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3grz RIBOSOMAL PROTEIN
L11
METHYLTRANSFERASE

(Lactobacillus
delbrueckii) 		PF06325
(PrmA) 		5 MET A 167
ALA A 166
ASN A 248
GLY A 169
ILE A 170
 None
 1.40A 2dcfA-3grzA:
undetectable		 2dcfA-3grzA:
20.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3hut PUTATIVE
BRANCHED-CHAIN AMINO
ACID ABC TRANSPORTER

(Rhodospirillum
rubrum) 		PF13458
(Peripla_BP_6) 		5 MET A 238
ALA A 237
VAL A 259
GLY A 182
ILE A 181
 None
 1.02A 2dcfA-3hutA:
undetectable		 2dcfA-3hutA:
24.48
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.
3icv LIPASE B

(Moesziomyces
antarcticus) 		no annotation 5 ALA A 164
VAL A 224
ASP A 221
TYR A 169
SER A 236
 None
 0.96A 2dcfA-3icvA:
undetectable		 2dcfA-3icvA:
22.06
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.
3ijp DIHYDRODIPICOLINATE
REDUCTASE

(Bartonella
henselae) 		PF01113
(DapB_N)
PF05173
(DapB_C) 		5 ALA A   8
VAL A  55
ASP A  43
GLY A  13
ILE A  17
 None
 1.00A 2dcfA-3ijpA:
undetectable		 2dcfA-3ijpA:
24.43
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.
3lcc PUTATIVE METHYL
CHLORIDE TRANSFERASE

(Arabidopsis
thaliana) 		PF05724
(TPMT) 		5 MET A 149
VAL A 124
ASP A 123
SER A 156
ILE A 145
 None
SAH  A 300 (-4.1A)
SAH  A 300 (-3.8A)
None
None
 1.16A 2dcfA-3lccA:
undetectable		 2dcfA-3lccA:
20.50
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.
3mca ELONGATION FACTOR 1
ALPHA-LIKE PROTEIN

(Schizosaccharomyces
pombe) 		PF00009
(GTP_EFTU)
PF03143
(GTP_EFTU_D3) 		5 ALA A 262
VAL A 182
ASP A 287
SER A 270
ILE A 197
 None
 1.17A 2dcfA-3mcaA:
undetectable		 2dcfA-3mcaA:
22.35
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.
3o04 BETA-KETO-ACYL
CARRIER PROTEIN
SYNTHASE II

(Listeria
monocytogenes) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		5 ALA A  21
TYR A 254
ASP A 359
GLY A  12
ILE A  11
 None
 1.34A 2dcfA-3o04A:
undetectable		 2dcfA-3o04A:
24.34
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.
3poh ENDO-BETA-N-ACETYLGL
UCOSAMINIDASE F1

(Bacteroides
thetaiotaomicron) 		PF08522
(DUF1735) 		5 ALA A 369
TYR A 359
VAL A 352
GLY A 388
ILE A 387
 None
 1.24A 2dcfA-3pohA:
undetectable		 2dcfA-3pohA:
20.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3q1n GALACTOSE MUTAROTASE
RELATED ENZYME

(Lactobacillus
paracasei) 		PF01263
(Aldose_epim) 		5 ALA A  11
TYR A 114
VAL A 123
GLY A  12
ILE A  13
 None
 1.38A 2dcfA-3q1nA:
undetectable		 2dcfA-3q1nA:
21.70
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.
3rr2 CYSTEINE SYNTHASE

(Mycobacterium
marinum) 		PF00291
(PALP) 		5 ALA A  78
SER A  42
ASN A  74
GLY A  48
ILE A  47
 None
 1.21A 2dcfA-3rr2A:
undetectable		 2dcfA-3rr2A:
21.64
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.
3s5s MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME
FAMILY PROTEIN

(Sorangium
cellulosum) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 ALA A  57
ASP A 247
ASN A  59
GLY A  28
ILE A  25
 None
 1.31A 2dcfA-3s5sA:
undetectable		 2dcfA-3s5sA:
23.76
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.
3wxw ADIPONECTIN RECEPTOR
PROTEIN 2

(Homo sapiens) 		PF03006
(HlyIII) 		5 ALA A 359
TYR A 321
TRP A 313
SER A 230
GLY A 358
 None
 1.40A 2dcfA-3wxwA:
undetectable		 2dcfA-3wxwA:
20.24
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.
3zei O-ACETYLSERINE
SULFHYDRYLASE

(Mycobacterium
tuberculosis) 		PF00291
(PALP) 		5 ALA A  78
SER A  42
ASN A  74
GLY A  48
ILE A  47
 None
None
PLP  A1301 (-3.8A)
None
None
 1.16A 2dcfA-3zeiA:
undetectable		 2dcfA-3zeiA:
21.95
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.
4af0 INOSINE-5'-MONOPHOSP
HATE DEHYDROGENASE

(Cryptococcus
neoformans) 		PF00478
(IMPDH)
PF00571
(CBS) 		5 TYR B 425
VAL B  91
SER B  86
GLY B 342
ILE B 344
 IMP  B1527 (-4.6A)
None
IMP  B1527 (-2.6A)
IMP  B1527 (-3.3A)
None
 1.41A 2dcfA-4af0B:
undetectable		 2dcfA-4af0B:
22.74
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.
4b2q ATP SYNTHASE SUBUNIT
BETA, MITOCHONDRIAL

(Saccharomyces
cerevisiae) 		PF00006
(ATP-synt_ab)
PF02874
(ATP-synt_ab_N) 		5 VAL D 141
ASP D 142
SER D 355
GLY D 151
ILE D 153
 None
 1.40A 2dcfA-4b2qD:
undetectable		 2dcfA-4b2qD:
23.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4evi CONIFERYL ALCOHOL
9-O-METHYLTRANSFERAS
E

(Linum
nodiflorum) 		PF00891
(Methyltransf_2)
PF08100
(Dimerisation) 		5 MET A 179
ALA A 180
VAL A 235
ASP A 231
GLY A 178
 SAH  A 401 (-3.6A)
None
SAH  A 401 (-4.8A)
SAH  A 401 (-2.9A)
None
 1.36A 2dcfA-4eviA:
undetectable		 2dcfA-4eviA:
21.99
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.
4gou EHRGS-RHOGEF

(Entamoeba
histolytica) 		PF00615
(RGS)
PF00621
(RhoGEF) 		5 ALA A 385
VAL A 450
TRP A 176
GLY A 406
ILE A 407
 None
 1.03A 2dcfA-4gouA:
undetectable		 2dcfA-4gouA:
20.44
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.
4ha4 BETA-GALACTOSIDASE

(Acidilobus
saccharovorans) 		PF00232
(Glyco_hydro_1) 		5 ALA A  16
SER A  20
ASN A 428
GLY A  82
ILE A  81
 None
 1.29A 2dcfA-4ha4A:
undetectable		 2dcfA-4ha4A:
24.06
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.
4hea NADH-QUINONE
OXIDOREDUCTASE
SUBUNIT 12

(Thermus
thermophilus) 		PF00361
(Proton_antipo_M)
PF00662
(Proton_antipo_N) 		5 ALA L 213
TYR L 260
VAL L 266
GLY L 249
ILE L 253
 None
 1.06A 2dcfA-4heaL:
undetectable		 2dcfA-4heaL:
21.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4hyn CHEC, INHIBITOR OF
MCP METHYLATION /
FLIN FUSION PROTEIN

(Thermotoga
maritima) 		PF04509
(CheC) 		5 MET A 138
ALA A 141
TYR A  86
GLY A 139
ILE A 155
 None
 1.33A 2dcfA-4hynA:
undetectable		 2dcfA-4hynA:
19.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4jrm 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 2

(Vibrio cholerae) 		no annotation 5 MET D 239
ALA D 188
VAL D   6
GLY D 189
ILE D 171
 None
 1.28A 2dcfA-4jrmD:
undetectable		 2dcfA-4jrmD:
24.03
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.
4kc8 GLYCOSIDE HYDROLASE,
FAMILY 43

(Thermotoga
petrophila) 		PF04616
(Glyco_hydro_43)
PF16369
(GH43_C) 		5 TYR A 210
VAL A 142
TYR A 160
SER A 144
GLY A 190
 None
 1.19A 2dcfA-4kc8A:
undetectable		 2dcfA-4kc8A:
22.85
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.
4kq9 RIBOSE ABC
TRANSPORTER,
SUBSTRATE BINDING
PROTEIN

(Conexibacter
woesei) 		PF13407
(Peripla_BP_4) 		5 ALA A 295
ASP A 137
PHE A 148
GLY A 292
ILE A  66
 None
GOL  A 502 (-2.8A)
GOL  A 503 ( 4.8A)
None
None
 1.29A 2dcfA-4kq9A:
undetectable		 2dcfA-4kq9A:
22.56
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.
4li3 CYSTEINE SYNTHASE

(Haemophilus
influenzae) 		PF00291
(PALP) 		5 ALA X  76
SER X  40
ASN X  72
GLY X  46
ILE X  45
 LLP  X  42 ( 3.2A)
LLP  X  42 ( 3.0A)
LLP  X  42 ( 3.8A)
LLP  X  42 ( 3.7A)
LLP  X  42 ( 4.0A)
 1.06A 2dcfA-4li3X:
undetectable		 2dcfA-4li3X:
23.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4lma CYSTEINE SYNTHASE

(Microcystis
aeruginosa) 		PF00291
(PALP) 		5 ALA A  81
SER A  44
ASN A  77
GLY A  50
ILE A  49
 None
PLP  A 403 ( 4.7A)
PLP  A 403 (-3.9A)
None
None
 1.09A 2dcfA-4lmaA:
undetectable		 2dcfA-4lmaA:
20.39
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.
4lmb CYSTEINE SYNTHASE

(Microcystis
aeruginosa) 		PF00291
(PALP) 		5 ALA A  81
SER A  44
ASN A  77
GLY A  50
ILE A  49
 None
None
PLP  A 403 ( 3.7A)
None
None
 1.13A 2dcfA-4lmbA:
undetectable		 2dcfA-4lmbA:
22.00
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.
4nj5 PROBABLE
HISTONE-LYSINE
N-METHYLTRANSFERASE,
H3 LYSINE-9 SPECIFIC
SUVH9

(Arabidopsis
thaliana) 		PF00856
(SET)
PF02182
(SAD_SRA)
PF05033
(Pre-SET) 		5 ALA A 295
VAL A 306
SER A 299
GLY A 292
ILE A 235
 None
 1.15A 2dcfA-4nj5A:
undetectable		 2dcfA-4nj5A:
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.
4p6y AMINOPEPTIDASE

(Thermotoga
maritima) 		PF05343
(Peptidase_M42) 		5 TYR A 287
SER A 194
ASN A  43
GLY A 191
ILE A  56
 None
 1.31A 2dcfA-4p6yA:
undetectable		 2dcfA-4p6yA:
23.19
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.
4pf8 TRAP-T FAMILY
TRANSPORTER, DCTP
(PERIPLASMIC
BINDING) SUBUNIT

(Sulfitobacter
sp. NAS-14.1) 		PF03480
(DctP) 		5 ALA A 206
PHE A 191
ASN A 208
GLY A 205
ILE A 198
 None
GTR  A 402 ( 3.7A)
GTR  A 402 (-2.9A)
None
None
 1.33A 2dcfA-4pf8A:
undetectable		 2dcfA-4pf8A:
20.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ph6 3-DEHYDROQUINATE
DEHYDRATASE

(Enterococcus
faecalis) 		PF01487
(DHquinase_I) 		5 ALA A 222
VAL A 139
PHE A 225
GLY A  12
ILE A  11
 None
 1.32A 2dcfA-4ph6A:
undetectable		 2dcfA-4ph6A:
21.93
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.
4pqk MALTOSE ABC
TRANSPORTER
PERIPLASMIC PROTEIN,
TRUNCATED
REPLICATION PROTEIN
REPA

(Escherichia
coli;
Staphylococcus
aureus) 		PF13416
(SBP_bac_8) 		5 ALA A 232
ASP A 297
TYR A 211
ASN A 235
GLY A 229
 None
 1.32A 2dcfA-4pqkA:
undetectable		 2dcfA-4pqkA:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4qfh GLUCOSE-6-PHOSPHATE
ISOMERASE

(Trypanosoma
cruzi) 		PF00342
(PGI) 		5 MET A 489
ASP A 103
TYR A 381
GLY A 524
ILE A  72
 None
 1.33A 2dcfA-4qfhA:
undetectable		 2dcfA-4qfhA:
22.06
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.
4qvh MALTOSE-BINDING
PERIPLASMIC PROTEIN,
4'-PHOSPHOPANTETHEIN
YL TRANSFERASE
CHIMERA

(Escherichia
coli;
Mycobacterium
tuberculosis) 		PF01648
(ACPS)
PF13416
(SBP_bac_8) 		5 ALA A 232
ASP A 297
TYR A 211
ASN A 235
GLY A 229
 None
 1.30A 2dcfA-4qvhA:
undetectable		 2dcfA-4qvhA:
22.85
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.
4r8e 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 2

(Yersinia pestis) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		5 MET A 238
ALA A 187
VAL A   5
GLY A 188
ILE A 170
 None
 1.28A 2dcfA-4r8eA:
undetectable		 2dcfA-4r8eA:
24.07
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.
4rk2 PUTATIVE SUGAR ABC
TRANSPORTER,
SUBSTRATE-BINDING
PROTEIN

(Rhizobium etli) 		PF01547
(SBP_bac_1) 		5 ALA A 398
TYR A 227
VAL A 203
GLY A 412
ILE A 402
 None
 1.41A 2dcfA-4rk2A:
undetectable		 2dcfA-4rk2A:
23.25
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.
4udn PERIPLASMIC SOLUTE
BINDING PROTEIN

(Candidatus
Liberibacter
asiaticus) 		PF01297
(ZnuA) 		5 MET A 115
ALA A 114
TYR A 143
TYR A 259
ILE A 118
 None
 1.15A 2dcfA-4udnA:
undetectable		 2dcfA-4udnA:
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.
4w99 ENOYL-[ACYL-CARRIER-
PROTEIN] REDUCTASE
[NADPH, B-SPECIFIC]
1, MITOCHONDRIAL

(Candida
tropicalis) 		no annotation 5 TYR A 370
VAL A  67
ASP A  71
TYR A 386
SER A  65
 None
 1.36A 2dcfA-4w99A:
undetectable		 2dcfA-4w99A:
21.58
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.
4y9l PROTEIN ACDH-11,
ISOFORM B

(Caenorhabditis
elegans) 		PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M) 		5 ALA A 324
VAL A 217
SER A 267
GLY A 325
ILE A 326
 None
 1.16A 2dcfA-4y9lA:
undetectable		 2dcfA-4y9lA:
22.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4y9v PARTICLE-ASSOCIATED
LYASE

(Acinetobacter
virus AP22) 		no annotation 5 ALA A 403
TYR A 392
VAL A 422
GLY A 381
ILE A 382
 None
 1.21A 2dcfA-4y9vA:
undetectable		 2dcfA-4y9vA:
20.09
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.
4yyf BETA-N-ACETYLHEXOSAM
INIDASE

(Mycolicibacterium
smegmatis) 		PF00933
(Glyco_hydro_3) 		5 ALA A 136
VAL A 125
ASP A 176
GLY A 140
ILE A 139
 None
 1.30A 2dcfA-4yyfA:
undetectable		 2dcfA-4yyfA:
24.89
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.
4zv7 LIPASE B

(Moesziomyces
antarcticus) 		no annotation 5 ALA A 130
VAL A 190
ASP A 187
TYR A 135
SER A 202
 None
 0.95A 2dcfA-4zv7A:
undetectable		 2dcfA-4zv7A:
23.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4zxi TYROCIDINE
SYNTHETASE 3

(Acinetobacter
baumannii) 		PF00501
(AMP-binding)
PF00550
(PP-binding)
PF00668
(Condensation)
PF00975
(Thioesterase)
PF13193
(AMP-binding_C) 		5 MET A 356
TYR A 262
VAL A 318
GLY A 355
ILE A 276
 None
 1.23A 2dcfA-4zxiA:
undetectable		 2dcfA-4zxiA:
16.02
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.
5ck0 SUSD HOMOLOG

(Bacteroides
thetaiotaomicron) 		PF07980
(SusD_RagB)
PF14322
(SusD-like_3) 		5 ALA A 408
VAL A 307
PHE A 433
GLY A 409
ILE A 410
 None
 1.38A 2dcfA-5ck0A:
undetectable		 2dcfA-5ck0A:
21.25
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.
5cxo EPOXIDE HYDROLASE

(Streptomyces
albus) 		PF12680
(SnoaL_2) 		5 MET A  87
ALA A  61
ASP A  38
SER A  57
ASN A  58
 P6G  A 202 (-3.1A)
None
P6G  A 202 (-3.8A)
P6G  A 202 (-3.2A)
P6G  A 202 (-3.2A)
 1.08A 2dcfA-5cxoA:
undetectable		 2dcfA-5cxoA:
17.05
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.
5dfm MALTOSE-BINDING
PERIPLASMIC
PROTEIN,TELOMERASE-A
SSOCIATED PROTEIN 19

(Escherichia
coli;
Tetrahymena
thermophila) 		PF13416
(SBP_bac_8) 		5 ALA A 231
ASP A 296
TYR A 210
ASN A 234
GLY A 228
 None
 1.29A 2dcfA-5dfmA:
undetectable		 2dcfA-5dfmA:
19.35
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.
5h4e BETA 1-3 GLUCANASE

(Clostridium
beijerinckii) 		no annotation 5 ALA A 426
TYR A 407
VAL A 411
PHE A 434
ILE A 424
 None
 1.23A 2dcfA-5h4eA:
undetectable		 2dcfA-5h4eA:
21.18
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.
5hus TREHALOSE SYNTHASE
REGULATORY PROTEIN

(Candida
albicans) 		PF02358
(Trehalose_PPase) 		5 ALA A 107
TYR A  72
VAL A 208
GLY A 106
ILE A 105
 None
 1.34A 2dcfA-5husA:
undetectable		 2dcfA-5husA:
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.
5jj4 MALTOSE-BINDING
PERIPLASMIC
PROTEIN,SINGLE-STRAN
DED DNA CYTOSINE
DEAMINASE

(Escherichia
coli;
Homo sapiens) 		no annotation 5 ALA C 231
ASP C 296
TYR C 210
ASN C 234
GLY C 228
 None
 1.32A 2dcfA-5jj4C:
undetectable		 2dcfA-5jj4C:
19.89
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.
5kp7 CURD

(Moorea
producens) 		PF01154
(HMG_CoA_synt_N)
PF08540
(HMG_CoA_synt_C) 		5 ALA A  43
VAL A  11
TYR A  54
GLY A 169
ILE A 297
 None
 0.96A 2dcfA-5kp7A:
undetectable		 2dcfA-5kp7A:
23.05
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.
5lrb ALPHA-1,4 GLUCAN
PHOSPHORYLASE

(Hordeum vulgare) 		PF00343
(Phosphorylase) 		5 TYR A 155
TRP A 236
SER A 109
GLY A 147
ILE A 146
 None
 1.25A 2dcfA-5lrbA:
undetectable		 2dcfA-5lrbA:
17.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5m11 IMMUNOREACTIVE 84KD
ANTIGEN PG93

(Porphyromonas
gingivalis) 		no annotation 5 MET A 554
ALA A 553
ASN A 490
GLY A 565
ILE A 551
 None
None
ZN  A 805 ( 4.8A)
None
None
 1.43A 2dcfA-5m11A:
undetectable		 2dcfA-5m11A:
21.89
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.
5mdm GLYCOPROTEIN

(Chandipura
vesiculovirus) 		no annotation 5 ALA E  49
TYR E 222
VAL E 262
SER E 264
GLY E 179
 None
 1.39A 2dcfA-5mdmE:
undetectable		 2dcfA-5mdmE:
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.
5mrj BETA-XYLANASE

(Acremonium
chrysogenum) 		no annotation 5 ALA A 303
VAL A 313
ASP A 267
GLY A 337
ILE A 335
 None
 1.18A 2dcfA-5mrjA:
undetectable		 2dcfA-5mrjA:
11.69
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.
5n1t FLAVIN-BINDING
SUBUNIT OF SULFIDE
DEHYDROGENASE

(Thioalkalivibrio
paradoxus) 		no annotation 5 MET A 328
ALA A 325
VAL A 341
GLY A 326
ILE A 387
 None
 1.19A 2dcfA-5n1tA:
undetectable		 2dcfA-5n1tA:
11.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ofb MORC FAMILY CW-TYPE
ZINC FINGER PROTEIN
2

(Homo sapiens) 		no annotation 5 MET B 405
ALA B 406
VAL B 372
TRP B 475
ILE B 461
 None
 1.20A 2dcfA-5ofbB:
undetectable		 2dcfA-5ofbB:
13.80
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.
5ou3 INOSINE-5'-MONOPHOSP
HATE
DEHYDROGENASE,INOSIN
E-5'-MONOPHOSPHATE
DEHYDROGENASE

(Mycolicibacterium
thermoresistibile) 		no annotation 5 TYR A 281
VAL A  73
SER A  68
GLY A 198
ILE A 200
 IMP  A 400 (-4.6A)
None
IMP  A 400 (-2.8A)
IMP  A 400 (-3.5A)
None
 1.33A 2dcfA-5ou3A:
undetectable		 2dcfA-5ou3A:
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.
5tuf TETRACYCLINE
DESTRUCTASE TET(50)

(uncultured
bacterium) 		PF01494
(FAD_binding_3) 		5 ALA A 291
TYR A 330
PHE A 167
GLY A 288
ILE A 287
 None
None
None
FAD  A 405 (-3.2A)
None
 1.30A 2dcfA-5tufA:
undetectable		 2dcfA-5tufA:
21.61
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.
5uth THIOREDOXIN
REDUCTASE

(Mycolicibacterium
smegmatis) 		PF07992
(Pyr_redox_2) 		5 MET A 114
ALA A 113
VAL A 275
GLY A  14
ILE A  13
 None
None
None
FAD  A 400 (-3.1A)
FAD  A 400 (-4.7A)
 1.00A 2dcfA-5uthA:
undetectable		 2dcfA-5uthA:
24.29
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.
5ux9 CHLORAMPHENICOL
ACETYLTRANSFERASE

(Aliivibrio
fischeri) 		PF00132
(Hexapep) 		5 ALA A 149
VAL A 137
ASN A 165
GLY A 146
ILE A 145
 None
 1.42A 2dcfA-5ux9A:
undetectable		 2dcfA-5ux9A:
21.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5xa2 CYSTEINE SYNTHASE

(Planctopirus
limnophila) 		PF00291
(PALP) 		5 ALA A  78
SER A  42
ASN A  74
GLY A  48
ILE A  47
 LLP  A  44 ( 3.2A)
LLP  A  44 ( 3.1A)
LLP  A  44 ( 3.8A)
LLP  A  44 ( 3.7A)
LLP  A  44 ( 4.1A)
 1.16A 2dcfA-5xa2A:
undetectable		 2dcfA-5xa2A:
21.99
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.
5zal ENDORIBONUCLEASE
DICER

(Homo sapiens) 		no annotation 5 MET A1808
TYR A1701
PHE A1766
GLY A1809
ILE A1811
 None
 1.39A 2dcfA-5zalA:
undetectable		 2dcfA-5zalA:
11.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6d72 SPERMIDINE
N1-ACETYLTRANSFERASE

(Yersinia pestis) 		no annotation 5 ALA A 100
TYR A 135
VAL A 124
GLY A 101
ILE A 134
 None
 1.37A 2dcfA-6d72A:
undetectable		 2dcfA-6d72A:
11.73