SIMILAR PATTERNS OF AMINO ACIDS FOR 4MWZ_A_SAMA301

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.
1ahi 7
ALPHA-HYDROXYSTEROID
DEHYDROGENASE

(Escherichia
coli) 		PF13561
(adh_short_C2) 		5 GLY A  18
GLY A  20
ILE A  43
ILE A  69
LEU A 117
 NAI  A 302 (-3.6A)
NAI  A 302 ( 4.1A)
NAI  A 302 (-4.0A)
NAI  A 302 (-3.8A)
None
 1.04A 4mwzA-1ahiA:
7.5		 4mwzA-1ahiA:
22.38
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.
1cqj SUCCINYL-COA
SYNTHETASE ALPHA
CHAIN

(Escherichia
coli) 		PF00549
(Ligase_CoA)
PF02629
(CoA_binding) 		5 TYR A 158
GLY A 125
GLY A 176
ILE A 127
ILE A 134
 None
 0.89A 4mwzA-1cqjA:
4.3		 4mwzA-1cqjA:
22.70
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.
1dlj UDP-GLUCOSE
DEHYDROGENASE

(Streptococcus
pyogenes) 		PF00984
(UDPG_MGDP_dh)
PF03720
(UDPG_MGDP_dh_C)
PF03721
(UDPG_MGDP_dh_N) 		5 GLY A 255
GLY A 257
ILE A 331
ILE A 294
SER A 253
 None
UGA  A 404 (-3.2A)
None
None
UGA  A 404 (-2.7A)
 1.12A 4mwzA-1dljA:
5.4		 4mwzA-1dljA:
24.52
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.
1fyh INTERFERON GAMMA
RECEPTOR 1

(Homo sapiens) 		PF01108
(Tissue_fac)
PF07140
(IFNGR1) 		5 ILE B 170
GLY B 202
ILE B 110
ARG B 153
HIS B 130
 None
 1.06A 4mwzA-1fyhB:
undetectable		 4mwzA-1fyhB:
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.
1gpl RP2 LIPASE

(Cavia porcellus) 		PF00151
(Lipase)
PF01477
(PLAT) 		5 TYR A 114
GLY A  76
ILE A 121
ILE A  74
SER A 152
 None
 0.99A 4mwzA-1gplA:
undetectable		 4mwzA-1gplA:
22.52
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.
1l9y FEZ-1 B-LACTAMASE

(Fluoribacter
gormanii) 		PF00753
(Lactamase_B) 		5 ILE A 219
GLY A 261
MET A 266
SER A 115
HIS A 116
 None
None
None
None
ZN  A   1 (-3.4A)
 1.02A 4mwzA-1l9yA:
undetectable		 4mwzA-1l9yA:
22.30
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.
1miu BREAST CANCER TYPE 2
SUSCEPTIBILITY
PROTEIN

(Mus musculus) 		PF09103
(BRCA-2_OB1)
PF09104
(BRCA-2_OB3)
PF09121
(Tower)
PF09169
(BRCA-2_helical) 		5 ILE A2509
GLY A2497
GLY A2499
SER A2404
LEU A2401
 None
 1.10A 4mwzA-1miuA:
undetectable		 4mwzA-1miuA:
18.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1oi7 SUCCINYL-COA
SYNTHETASE ALPHA
CHAIN

(Thermus
thermophilus) 		PF00549
(Ligase_CoA)
PF02629
(CoA_binding) 		5 TYR A 158
GLY A 125
GLY A 176
ILE A 127
ILE A 134
 None
 0.73A 4mwzA-1oi7A:
4.4		 4mwzA-1oi7A:
21.65
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.
1qv9 F420-DEPENDENT
METHYLENETETRAHYDROM
ETHANOPTERIN
DEHYDROGENASE

(Methanopyrus
kandleri) 		PF01993
(MTD) 		5 GLY A  72
GLY A  12
MET A  44
ILE A  96
LEU A 118
 None
 1.12A 4mwzA-1qv9A:
undetectable		 4mwzA-1qv9A:
24.52
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.
1sc6 D-3-PHOSPHOGLYCERATE
DEHYDROGENASE

(Escherichia
coli) 		PF00389
(2-Hacid_dh)
PF01842
(ACT)
PF02826
(2-Hacid_dh_C) 		5 ILE A  84
GLY A  85
ILE A  79
ARG A  60
LEU A 312
 None
 1.07A 4mwzA-1sc6A:
6.3		 4mwzA-1sc6A:
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.
1txg GLYCEROL-3-PHOSPHATE
DEHYDROGENASE
[NAD(P)+]

(Archaeoglobus
fulgidus) 		PF01210
(NAD_Gly3P_dh_N)
PF07479
(NAD_Gly3P_dh_C) 		5 ILE A 103
GLY A   9
GLY A  78
ILE A  28
ILE A  37
 None
 1.03A 4mwzA-1txgA:
5.4		 4mwzA-1txgA:
24.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ve3 HYPOTHETICAL PROTEIN
PH0226

(Pyrococcus
horikoshii) 		PF13649
(Methyltransf_25) 		5 GLY A  48
ILE A  68
MET A  72
SER A 112
HIS A 115
 SAM  A 302 (-3.6A)
SAM  A 302 (-3.7A)
SAM  A 302 (-3.9A)
SAM  A 302 (-3.3A)
SAM  A 302 (-3.8A)
 0.76A 4mwzA-1ve3A:
19.8		 4mwzA-1ve3A:
25.27
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.
1ve3 HYPOTHETICAL PROTEIN
PH0226

(Pyrococcus
horikoshii) 		PF13649
(Methyltransf_25) 		5 TYR A   7
GLY A  48
MET A  72
SER A 112
HIS A 115
 SAM  A 302 (-4.6A)
SAM  A 302 (-3.6A)
SAM  A 302 (-3.9A)
SAM  A 302 (-3.3A)
SAM  A 302 (-3.8A)
 0.89A 4mwzA-1ve3A:
19.8		 4mwzA-1ve3A:
25.27
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.
1w1w STRUCTURAL
MAINTENANCE OF
CHROMOSOME 1

(Saccharomyces
cerevisiae) 		PF02463
(SMC_N) 		5 ILE A1215
GLY A  33
GLY A1203
ILE A1188
SER A  37
 None
None
None
None
AGS  A2224 (-3.5A)
 0.93A 4mwzA-1w1wA:
undetectable		 4mwzA-1w1wA:
22.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1x9n DNA LIGASE I

(Homo sapiens) 		PF01068
(DNA_ligase_A_M)
PF04675
(DNA_ligase_A_N)
PF04679
(DNA_ligase_A_C) 		5 GLY A 380
ILE A 442
ILE A 427
SER A 447
LEU A 347
 None
 1.04A 4mwzA-1x9nA:
undetectable		 4mwzA-1x9nA:
16.77
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.
1y8a HYPOTHETICAL PROTEIN
AF1437

(Archaeoglobus
fulgidus) 		no annotation 5 TYR A 193
GLY A 121
MET A   1
HIS A 124
LEU A 110
 None
 1.02A 4mwzA-1y8aA:
undetectable		 4mwzA-1y8aA:
22.01
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.
1zbs HYPOTHETICAL PROTEIN
PG1100

(Porphyromonas
gingivalis) 		PF01869
(BcrAD_BadFG) 		5 TYR A 248
GLY A 117
GLY A 147
ILE A 115
SER A 243
 None
 1.07A 4mwzA-1zbsA:
undetectable		 4mwzA-1zbsA:
22.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2b61 HOMOSERINE
O-ACETYLTRANSFERASE

(Haemophilus
influenzae) 		PF00561
(Abhydrolase_1) 		5 GLY A 141
GLY A 146
ILE A 139
ILE A  45
LEU A 355
 None
 1.11A 4mwzA-2b61A:
2.2		 4mwzA-2b61A:
19.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2fpg SUCCINYL-COA LIGASE
[GDP-FORMING]
ALPHA-CHAIN,
MITOCHONDRIAL

(Sus scrofa) 		PF00549
(Ligase_CoA)
PF02629
(CoA_binding) 		5 GLY A 134
GLY A 185
ILE A 136
CYH A 183
ILE A 143
 None
 1.02A 4mwzA-2fpgA:
3.5		 4mwzA-2fpgA:
21.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2fpg SUCCINYL-COA LIGASE
[GDP-FORMING]
ALPHA-CHAIN,
MITOCHONDRIAL

(Sus scrofa) 		PF00549
(Ligase_CoA)
PF02629
(CoA_binding) 		5 TYR A 167
GLY A 134
GLY A 185
ILE A 136
ILE A 143
 None
 0.90A 4mwzA-2fpgA:
3.5		 4mwzA-2fpgA:
21.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2i7t CLEAVAGE AND
POLYADENYLATION
SPECIFICITY FACTOR
73 KDA SUBUNIT

(Homo sapiens) 		PF00753
(Lactamase_B)
PF07521
(RMMBL)
PF10996
(Beta-Casp) 		5 ILE A  56
GLY A  42
ILE A  69
MET A  38
LEU A 107
 None
 1.08A 4mwzA-2i7tA:
undetectable		 4mwzA-2i7tA:
21.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2o8e DNA MISMATCH REPAIR
PROTEIN MSH6

(Homo sapiens) 		PF00488
(MutS_V)
PF01624
(MutS_I)
PF05188
(MutS_II)
PF05190
(MutS_IV)
PF05192
(MutS_III) 		5 GLY B 467
GLY B 529
ARG B 482
SER B 470
LEU B 447
 None
 1.12A 4mwzA-2o8eB:
undetectable		 4mwzA-2o8eB:
13.75
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.
2pvp D-ALANINE-D-ALANINE
LIGASE

(Helicobacter
pylori) 		PF01820
(Dala_Dala_lig_N)
PF07478
(Dala_Dala_lig_C) 		5 ILE A 304
GLY A 103
GLY A 100
ARG A 120
SER A 124
 None
 0.85A 4mwzA-2pvpA:
undetectable		 4mwzA-2pvpA:
23.70
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.
2qjg PUTATIVE ALDOLASE
MJ0400

(Methanocaldococcus
jannaschii) 		PF01791
(DeoC) 		5 GLY A  39
ILE A  47
ARG A 238
HIS A  65
LEU A  64
 None
None
F2P  A 501 (-3.9A)
None
None
 1.03A 4mwzA-2qjgA:
undetectable		 4mwzA-2qjgA:
27.21
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.
2vbi PYRUVATE
DECARBOXYLASE

(Acetobacter
pasteurianus) 		PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N) 		5 GLY A 499
ILE A 458
MET A 489
ILE A 457
ARG A 522
 None
 1.10A 4mwzA-2vbiA:
2.7		 4mwzA-2vbiA:
20.25
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.
2vv8 SENSOR PROTEIN FIXL

(Bradyrhizobium
japonicum) 		PF00989
(PAS) 		5 ILE A 216
GLY A 251
GLY A 239
ILE A 159
LEU A 191
 HEM  A1258 (-4.0A)
HEM  A1258 (-3.8A)
None
HEM  A1258 (-4.0A)
HEM  A1258 (-4.2A)
 1.09A 4mwzA-2vv8A:
undetectable		 4mwzA-2vv8A:
15.87
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.
2w9m POLYMERASE X

(Deinococcus
radiodurans) 		PF14520
(HHH_5)
PF14716
(HHH_8) 		5 ILE A  62
ILE A  69
ARG A  35
SER A  39
LEU A  17
 None
 1.05A 4mwzA-2w9mA:
undetectable		 4mwzA-2w9mA:
18.17
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.
2xr4 LECTIN

(Burkholderia
cenocepacia) 		PF07472
(PA-IIL) 		5 ILE A  28
ILE A  67
ARG A  73
SER A  75
LEU A  77
 None
 0.98A 4mwzA-2xr4A:
undetectable		 4mwzA-2xr4A:
16.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2xt6 2-OXOGLUTARATE
DECARBOXYLASE

(Mycolicibacterium
smegmatis) 		PF00198
(2-oxoacid_dh)
PF00676
(E1_dh)
PF02779
(Transket_pyr)
PF16870
(OxoGdeHyase_C) 		5 GLY A 995
ILE A 987
ILE A 988
ARG A1062
LEU A1007
 None
 1.08A 4mwzA-2xt6A:
undetectable		 4mwzA-2xt6A:
13.55
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.
2zm5 TRNA
DELTA(2)-ISOPENTENYL
PYROPHOSPHATE
TRANSFERASE

(Escherichia
coli) 		PF01715
(IPPT) 		5 GLY A  17
GLY A 106
ILE A 283
SER A  21
LEU A 210
 None
 0.96A 4mwzA-2zm5A:
2.8		 4mwzA-2zm5A:
21.78
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.
3bus METHYLTRANSFERASE

(Lechevalieria
aerocolonigenes) 		PF08241
(Methyltransf_11) 		5 GLY A  69
GLY A  71
ILE A  92
SER A 138
HIS A 141
 SAH  A 274 (-3.1A)
SAH  A 274 (-3.4A)
SAH  A 274 (-4.0A)
None
SAH  A 274 (-4.0A)
 0.89A 4mwzA-3busA:
25.4		 4mwzA-3busA:
25.43
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.
3cjp PREDICTED
AMIDOHYDROLASE,
DIHYDROOROTASE
FAMILY

(Clostridium
acetobutylicum) 		PF04909
(Amidohydro_2) 		5 TYR A 106
ILE A  74
GLY A 120
GLY A  92
ILE A 135
 None
 1.00A 4mwzA-3cjpA:
undetectable		 4mwzA-3cjpA:
22.37
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.
3clh 3-DEHYDROQUINATE
SYNTHASE

(Helicobacter
pylori) 		PF01761
(DHQ_synthase) 		5 GLY A 171
GLY A 249
ILE A 176
ILE A 175
LEU A 195
 None
 1.03A 4mwzA-3clhA:
undetectable		 4mwzA-3clhA:
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.
3d2l SAM-DEPENDENT
METHYLTRANSFERASE

(Exiguobacterium
sibiricum) 		PF13649
(Methyltransf_25) 		5 GLY A  40
GLY A  42
MET A  65
SER A 105
LEU A 109
 None
 0.51A 4mwzA-3d2lA:
17.9		 4mwzA-3d2lA:
23.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3dtn PUTATIVE
METHYLTRANSFERASE
MM_2633

(Methanosarcina
mazei) 		PF13649
(Methyltransf_25) 		5 GLY A  50
GLY A  52
SER A 116
HIS A 119
LEU A 120
 None
 0.82A 4mwzA-3dtnA:
19.0		 4mwzA-3dtnA:
28.26
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.
3e0x LIPASE-ESTERASE
RELATED PROTEIN

(Clostridium
acetobutylicum) 		PF12146
(Hydrolase_4) 		5 GLY A  21
GLY A  23
MET A 165
ILE A  94
SER A  89
 OXE  A 243 (-3.8A)
None
OXE  A 243 ( 4.6A)
None
OXE  A 243 (-2.8A)
 1.13A 4mwzA-3e0xA:
2.4		 4mwzA-3e0xA:
25.93
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.
3e73 LANC-LIKE PROTEIN 1

(Homo sapiens) 		PF05147
(LANC_like) 		5 GLY A 375
GLY A 320
ILE A 380
SER A 371
LEU A  51
 None
 1.12A 4mwzA-3e73A:
undetectable		 4mwzA-3e73A:
18.93
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.
3elu METHYLTRANSFERASE

(Wesselsbron
virus) 		PF00972
(Flavi_NS5)
PF01728
(FtsJ) 		5 ILE A  62
GLY A  85
ILE A 114
SER A  56
LEU A  44
 None
SAM  A4633 ( 4.3A)
None
SAM  A4633 ( 2.7A)
None
 1.12A 4mwzA-3eluA:
8.5		 4mwzA-3eluA:
22.76
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.
3en0 CYANOPHYCINASE

(Synechocystis
sp. PCC 6803) 		PF03575
(Peptidase_S51) 		6 TYR A  56
ILE A  52
GLY A 134
GLY A  98
ILE A  12
ILE A  11
 None
 1.40A 4mwzA-3en0A:
3.9		 4mwzA-3en0A:
21.97
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.
3fnk CELLULOSOMAL
SCAFFOLDIN ADAPTOR
PROTEIN B

(Acetivibrio
cellulolyticus) 		PF00963
(Cohesin) 		5 ILE A  46
GLY A 124
ILE A  27
MET A  14
ILE A  26
 None
 0.93A 4mwzA-3fnkA:
undetectable		 4mwzA-3fnkA:
20.96
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.
3gdn R-OXYNITRILE LYASE
ISOENZYME 1

(Prunus dulcis) 		PF00732
(GMC_oxred_N)
PF05199
(GMC_oxred_C) 		5 ILE A 108
GLY A  34
GLY A 105
ILE A  31
LEU A 209
 None
None
FAD  A 522 (-3.1A)
None
None
 1.08A 4mwzA-3gdnA:
undetectable		 4mwzA-3gdnA:
19.15
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.
3gq9 PRENECK APPENDAGE
PROTEIN

(Bacillus virus
phi29) 		PF11962
(Peptidase_G2)
PF12708
(Pectate_lyase_3) 		5 TYR A 360
GLY A 308
GLY A 330
ILE A 282
SER A 325
 None
 1.09A 4mwzA-3gq9A:
undetectable		 4mwzA-3gq9A:
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.
3hd6 AMMONIUM TRANSPORTER
RH TYPE C

(Homo sapiens) 		PF00909
(Ammonium_transp) 		5 GLY A 352
GLY A 355
ILE A 350
ILE A 349
SER A 181
 None
 1.08A 4mwzA-3hd6A:
undetectable		 4mwzA-3hd6A:
18.24
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.
3ics COENZYME A-DISULFIDE
REDUCTASE

(Bacillus
anthracis) 		PF00581
(Rhodanese)
PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		5 GLY A 245
ILE A 159
ILE A 241
ARG A 136
LEU A 132
 None
None
None
FAD  A 555 (-4.2A)
None
 0.95A 4mwzA-3icsA:
2.5		 4mwzA-3icsA:
18.66
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.
3j1c CHAPERONIN ALPHA
SUBUNIT

(Acidianus
tengchongensis) 		PF00118
(Cpn60_TCP1) 		5 ILE A 493
GLY A 419
GLY A 485
ILE A 421
LEU A 451
 None
 1.10A 4mwzA-3j1cA:
undetectable		 4mwzA-3j1cA:
19.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3kgk ARSENICAL RESISTANCE
OPERON TRANS-ACTING
REPRESSOR ARSD

(Escherichia
coli) 		PF06953
(ArsD) 		5 TYR A  88
GLY A  72
GLY A  86
ILE A  65
LEU A  48
 None
 1.05A 4mwzA-3kgkA:
undetectable		 4mwzA-3kgkA:
17.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3mgg METHYLTRANSFERASE

(Methanosarcina
mazei) 		PF13847
(Methyltransf_31) 		5 GLY A  43
GLY A  45
ILE A  94
HIS A 115
LEU A 116
 None
 0.89A 4mwzA-3mggA:
16.9		 4mwzA-3mggA:
25.00
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.
3mgg METHYLTRANSFERASE

(Methanosarcina
mazei) 		PF13847
(Methyltransf_31) 		6 ILE A  46
GLY A  43
GLY A  45
ILE A  67
ILE A  94
LEU A 116
 None
 1.27A 4mwzA-3mggA:
16.9		 4mwzA-3mggA:
25.00
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.
3oyt 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE I

(Yersinia pestis) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		5 ILE A  15
GLY A  50
GLY A  32
ILE A 232
LEU A 336
 None
 1.04A 4mwzA-3oytA:
undetectable		 4mwzA-3oytA:
21.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3p6l SUGAR PHOSPHATE
ISOMERASE/EPIMERASE

(Parabacteroides
distasonis) 		PF01261
(AP_endonuc_2) 		5 ILE A 256
GLY A  35
ILE A  99
ILE A 101
LEU A  46
 None
 1.04A 4mwzA-3p6lA:
undetectable		 4mwzA-3p6lA:
24.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3pl2 SUGAR KINASE,
RIBOKINASE FAMILY

(Corynebacterium
glutamicum) 		PF00294
(PfkB) 		5 GLY A 267
GLY A 263
ILE A 230
ILE A 168
LEU A 274
 None
 1.13A 4mwzA-3pl2A:
3.3		 4mwzA-3pl2A:
22.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ptw MALONYL COA-ACYL
CARRIER PROTEIN
TRANSACYLASE

(Clostridium
perfringens) 		PF00698
(Acyl_transf_1) 		5 ILE A 225
GLY A   5
ILE A 271
SER A  84
HIS A 100
 None
 1.12A 4mwzA-3ptwA:
undetectable		 4mwzA-3ptwA:
23.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3rhg PUTATIVE
PHOPHOTRIESTERASE

(Proteus
mirabilis) 		PF02126
(PTE) 		5 ILE A 164
GLY A  97
GLY A 124
ILE A 154
LEU A 108
 None
 1.00A 4mwzA-3rhgA:
undetectable		 4mwzA-3rhgA:
21.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3suc PRENECK APPENDAGE
PROTEIN

(Bacillus virus
phi29) 		PF11962
(Peptidase_G2)
PF12708
(Pectate_lyase_3) 		5 TYR A 360
GLY A 308
GLY A 330
ILE A 282
SER A 325
 None
 1.08A 4mwzA-3sucA:
undetectable		 4mwzA-3sucA:
15.21
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.
3swd UDP-N-ACETYLGLUCOSAM
INE
1-CARBOXYVINYLTRANSF
ERASE

(Escherichia
coli) 		PF00275
(EPSP_synthase) 		5 ILE A 182
GLY A 128
MET A 158
ILE A 126
LEU A  97
 None
 1.09A 4mwzA-3swdA:
undetectable		 4mwzA-3swdA:
20.49
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.
3tmc UNCHARACTERIZED
PROTEIN

(Bdellovibrio
bacteriovorus) 		PF13487
(HD_5) 		5 ILE A 214
GLY A 186
GLY A 216
ILE A 147
LEU A 194
 None
None
None
None
PO4  A 311 ( 4.4A)
 1.02A 4mwzA-3tmcA:
undetectable		 4mwzA-3tmcA:
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.
3to3 PETROBACTIN
BIOSYNTHESIS PROTEIN
ASBB

(Bacillus
anthracis) 		PF04183
(IucA_IucC)
PF06276
(FhuF) 		5 ILE A 397
GLY A 386
ILE A 441
ILE A 452
HIS A 444
 None
 1.02A 4mwzA-3to3A:
undetectable		 4mwzA-3to3A:
18.05
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.
4eb5 PROBABLE CYSTEINE
DESULFURASE 2

(Archaeoglobus
fulgidus) 		PF00266
(Aminotran_5) 		5 ILE A 200
GLY A 242
GLY A 202
ILE A 240
ARG A  15
 None
 1.09A 4mwzA-4eb5A:
2.3		 4mwzA-4eb5A:
22.17
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.
4fbq DNA REPAIR AND
TELOMERE MAINTENANCE
PROTEIN NBS1,DNA
REPAIR PROTEIN RAD32
CHIMERIC PROTEIN

(Schizosaccharomyces
pombe) 		PF00149
(Metallophos)
PF04152
(Mre11_DNA_bind) 		5 GLY A1063
GLY A1249
ILE A1066
HIS A1131
LEU A1146
 None
 1.10A 4mwzA-4fbqA:
undetectable		 4mwzA-4fbqA:
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.
4ine PROTEIN PMT-2

(Caenorhabditis
elegans) 		PF08241
(Methyltransf_11) 		6 ILE A 204
GLY A 232
GLY A 234
MET A 259
ARG A 298
HIS A 303
 SAH  A 501 (-4.5A)
SAH  A 501 (-3.6A)
SAH  A 501 (-3.6A)
SAH  A 501 (-3.9A)
None
SAH  A 501 (-4.0A)
 0.89A 4mwzA-4ineA:
36.3		 4mwzA-4ineA:
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.
4ine PROTEIN PMT-2

(Caenorhabditis
elegans) 		PF08241
(Methyltransf_11) 		6 TYR A 187
ILE A 204
GLY A 232
GLY A 234
ARG A 298
HIS A 303
 SAH  A 501 ( 4.1A)
SAH  A 501 (-4.5A)
SAH  A 501 (-3.6A)
SAH  A 501 (-3.6A)
None
SAH  A 501 (-4.0A)
 0.69A 4mwzA-4ineA:
36.3		 4mwzA-4ineA:
24.04
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4iv8 PHOSPHOETHANOLAMINE
N-METHYLTRANSFERASE,
PUTATIVE

(Plasmodium
knowlesi) 		PF08241
(Methyltransf_11) 		9 GLY A  61
GLY A  63
ILE A  84
CYH A  85
MET A  88
ILE A 109
ARG A 125
HIS A 130
LEU A 131
 SAM  A 301 (-3.5A)
SAM  A 301 ( 3.9A)
SAM  A 301 (-3.8A)
BME  A 302 (-1.9A)
SAM  A 301 (-3.3A)
SAM  A 301 (-4.1A)
None
SAM  A 301 (-3.9A)
None
 0.34A 4mwzA-4iv8A:
36.4		 4mwzA-4iv8A:
87.64
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4iv8 PHOSPHOETHANOLAMINE
N-METHYLTRANSFERASE,
PUTATIVE

(Plasmodium
knowlesi) 		PF08241
(Methyltransf_11) 		6 GLY A  63
CYH A  85
MET A  88
ILE A  60
HIS A 130
LEU A 131
 SAM  A 301 ( 3.9A)
BME  A 302 (-1.9A)
SAM  A 301 (-3.3A)
None
SAM  A 301 (-3.9A)
None
 1.27A 4mwzA-4iv8A:
36.4		 4mwzA-4iv8A:
87.64
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.
4j3b M1 FAMILY
AMINOPEPTIDASE

(Plasmodium
falciparum) 		PF01433
(Peptidase_M1)
PF11940
(DUF3458)
PF17432
(DUF3458_C) 		5 ILE A1013
GLY A1017
GLY A1015
ILE A1021
ARG A1009
 None
 1.00A 4mwzA-4j3bA:
undetectable		 4mwzA-4j3bA:
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.
4kri PHOSPHOLETHANOLAMINE
N-METHYLTRANSFERASE
2

(Haemonchus
contortus) 		PF08241
(Methyltransf_11) 		5 TYR A 183
GLY A 230
MET A 255
ILE A 227
HIS A 299
 SAH  A 701 ( 4.2A)
SAH  A 701 (-3.5A)
SAH  A 701 (-3.9A)
None
SAH  A 701 (-4.2A)
 1.05A 4mwzA-4kriA:
36.3		 4mwzA-4kriA:
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.
4kri PHOSPHOLETHANOLAMINE
N-METHYLTRANSFERASE
2

(Haemonchus
contortus) 		PF08241
(Methyltransf_11) 		7 TYR A 183
ILE A 200
GLY A 228
GLY A 230
MET A 255
ARG A 294
HIS A 299
 SAH  A 701 ( 4.2A)
SAH  A 701 ( 4.5A)
SAH  A 701 (-3.5A)
SAH  A 701 (-3.5A)
SAH  A 701 (-3.9A)
None
SAH  A 701 (-4.2A)
 0.84A 4mwzA-4kriA:
36.3		 4mwzA-4kriA:
22.48
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4mwz PHOSPHOETHANOLAMINE
N-METHYLTRANSFERASE,
PUTATIVE

(Plasmodium
vivax) 		PF13649
(Methyltransf_25) 		7 TYR A  16
GLY A  62
CYH A  84
MET A  87
ILE A  59
HIS A 129
LEU A 130
 SAM  A 301 ( 4.3A)
SAM  A 301 ( 3.8A)
BME  A 303 (-1.9A)
SAM  A 301 (-3.0A)
None
SAM  A 301 (-3.9A)
None
 1.16A 4mwzA-4mwzA:
47.3		 4mwzA-4mwzA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4mwz PHOSPHOETHANOLAMINE
N-METHYLTRANSFERASE,
PUTATIVE

(Plasmodium
vivax) 		PF13649
(Methyltransf_25) 		12 TYR A  16
ILE A  33
GLY A  60
GLY A  62
ILE A  83
CYH A  84
MET A  87
ILE A 108
ARG A 124
SER A 126
HIS A 129
LEU A 130
 SAM  A 301 ( 4.3A)
SAM  A 301 (-4.3A)
SAM  A 301 (-3.7A)
SAM  A 301 ( 3.8A)
SAM  A 301 (-3.7A)
BME  A 303 (-1.9A)
SAM  A 301 (-3.0A)
SAM  A 301 (-4.0A)
None
SAM  A 301 (-3.2A)
SAM  A 301 (-3.9A)
None
 0.02A 4mwzA-4mwzA:
47.3		 4mwzA-4mwzA:
100.00
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.
4na3 POLYKETIDE SYNTHASE
PKSJ

(Bacillus
subtilis) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C)
PF16197
(KAsynt_C_assoc) 		5 GLY A 267
ILE A 183
ILE A 428
ARG A 425
LEU A 374
 None
 1.05A 4mwzA-4na3A:
undetectable		 4mwzA-4na3A:
20.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4nhy 2-OXOGLUTARATE AND
IRON-DEPENDENT
OXYGENASE
DOMAIN-CONTAINING
PROTEIN 1

(Homo sapiens) 		PF10637
(Ofd1_CTDD)
PF13661
(2OG-FeII_Oxy_4) 		5 ILE A 139
GLY A 235
ILE A 233
ILE A 167
LEU A 207
 None
None
None
PD2  A 603 ( 4.2A)
None
 1.10A 4mwzA-4nhyA:
undetectable		 4mwzA-4nhyA:
19.26
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.
4nwz FAD-DEPENDENT
PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE

(Caldalkalibacillus
thermarum) 		PF07992
(Pyr_redox_2) 		5 ILE A 296
GLY A  14
GLY A 298
ILE A  16
LEU A  35
 None
FAD  A 601 (-4.2A)
FAD  A 601 (-3.0A)
None
None
 1.10A 4mwzA-4nwzA:
3.8		 4mwzA-4nwzA:
19.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4o6r ALDEHYDE
DEHYDROGENASE

(Burkholderia
cenocepacia) 		PF00171
(Aldedh) 		5 ILE A 282
GLY A 409
GLY A 411
MET A 433
SER A 454
 NO3  A 502 (-4.8A)
None
None
None
None
 1.08A 4mwzA-4o6rA:
4.3		 4mwzA-4o6rA:
17.54
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.
4qdk MAGNESIUM-PROTOPORPH
YRIN
O-METHYLTRANSFERASE

(Synechocystis
sp. PCC 6803) 		PF07109
(Mg-por_mtran_C) 		5 GLY A  70
GLY A  72
ILE A  92
MET A  96
HIS A 139
 SAH  A 301 (-3.4A)
SAH  A 301 (-3.6A)
SAH  A 301 (-3.6A)
SAH  A 301 (-4.2A)
None
 0.93A 4mwzA-4qdkA:
17.4		 4mwzA-4qdkA:
22.89
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4r6w PHOSPHOETHANOLAMINE
N-METHYLTRANSFERASE

(Plasmodium
falciparum) 		PF13649
(Methyltransf_25) 		7 TYR A  19
ILE A  36
GLY A  63
GLY A  65
CYH A  87
ILE A 111
ARG A 127
 SAH  A 302 ( 4.1A)
SAH  A 302 ( 3.9A)
SAH  A 302 (-3.7A)
SAH  A 302 (-3.6A)
SAH  A 302 (-3.4A)
SAH  A 302 (-4.1A)
None
 0.75A 4mwzA-4r6wA:
41.1		 4mwzA-4r6wA:
63.77
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4r6w PHOSPHOETHANOLAMINE
N-METHYLTRANSFERASE

(Plasmodium
falciparum) 		PF13649
(Methyltransf_25) 		9 TYR A  19
ILE A  36
GLY A  63
GLY A  65
ILE A  86
ILE A 111
ARG A 127
HIS A 132
LEU A 133
 SAH  A 302 ( 4.1A)
SAH  A 302 ( 3.9A)
SAH  A 302 (-3.7A)
SAH  A 302 (-3.6A)
SAH  A 302 (-3.7A)
SAH  A 302 (-4.1A)
None
SAH  A 302 (-4.3A)
None
 0.33A 4mwzA-4r6wA:
41.1		 4mwzA-4r6wA:
63.77
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.
4r7o GLYCEROPHOSPHORYL
DIESTER
PHOSPHODIESTERASE,
PUTATIVE

(Bacillus
anthracis) 		PF03009
(GDPD) 		5 TYR A 150
GLY A 250
ILE A 282
ARG A 271
LEU A 307
 None
 1.10A 4mwzA-4r7oA:
undetectable		 4mwzA-4r7oA:
22.98
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.
4w8y CRISPR SYSTEM CMR
SUBUNIT CMR2

(Pyrococcus
furiosus) 		PF12469
(DUF3692) 		5 GLY A 671
ILE A 668
ILE A 233
SER A 250
HIS A 247
 None
 1.03A 4mwzA-4w8yA:
undetectable		 4mwzA-4w8yA:
16.38
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.
4wi0 CELLULOSOMAL
SCAFFOLDIN ADAPTOR
PROTEIN B

(Acetivibrio
cellulolyticus) 		PF00963
(Cohesin) 		5 ILE A  39
GLY A 117
ILE A  20
MET A   7
ILE A  19
 None
 0.94A 4mwzA-4wi0A:
undetectable		 4mwzA-4wi0A:
22.27
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.
4xox 3-OXOACYL-ACP
SYNTHASE

(Vibrio cholerae) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		5 ILE A  15
GLY A  50
GLY A  32
ILE A 229
LEU A 332
 None
 1.01A 4mwzA-4xoxA:
undetectable		 4mwzA-4xoxA:
20.62
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.
5adv ENTEROCHELIN UPTAKE
PERIPLASMIC BINDING
PROTEIN

(Campylobacter
jejuni) 		PF01497
(Peripla_BP_2) 		5 GLY A 225
ILE A 222
ILE A 189
ARG A 249
SER A 198
 None
None
None
DBS  A1313 ( 3.5A)
None
 1.07A 4mwzA-5advA:
undetectable		 4mwzA-5advA:
22.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5avo HOMOSERINE
DEHYDROGENASE

(Sulfurisphaera
tokodaii) 		PF00742
(Homoserine_dh)
PF03447
(NAD_binding_3) 		5 GLY A 291
GLY A 132
ILE A 136
ARG A  23
SER A 294
 None
 1.10A 4mwzA-5avoA:
2.5		 4mwzA-5avoA:
22.44
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.
5b58 PUTATIVE HEMIN ABC
TRANSPORT SYSTEM,
MEMBRANE PROTEIN

(Burkholderia
cenocepacia) 		PF01032
(FecCD) 		5 GLY A 117
GLY A 114
ILE A 181
ILE A 183
SER A 120
 None
 1.10A 4mwzA-5b58A:
undetectable		 4mwzA-5b58A:
15.76
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.
5c2c FORM II RUBISCO

(Gallionella) 		PF00016
(RuBisCO_large)
PF02788
(RuBisCO_large_N) 		5 ILE A 164
GLY A 369
GLY A 393
ILE A 367
HIS A 321
 KCX  A 191 ( 4.1A)
None
None
None
KCX  A 191 ( 3.5A)
 1.10A 4mwzA-5c2cA:
undetectable		 4mwzA-5c2cA:
22.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5dly PLANTAZOLICIN
METHYLTRANSFERASE
BAML

(Bacillus
velezensis) 		PF13847
(Methyltransf_31) 		5 ILE A  97
GLY A  68
GLY A  70
ILE A 130
LEU A 147
 None
SAH  A 301 (-3.6A)
SAH  A 301 ( 3.7A)
None
None
 1.11A 4mwzA-5dlyA:
15.8		 4mwzA-5dlyA:
23.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5dm4 METHYLTRANSFERASE
DOMAIN FAMILY

(Bacillus
pumilus) 		PF13489
(Methyltransf_23) 		5 ILE A 109
GLY A  88
ILE A 126
ILE A 128
LEU A 141
 None
None
None
None
GOL  A 301 (-4.4A)
 1.01A 4mwzA-5dm4A:
16.2		 4mwzA-5dm4A:
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.
5e1b N-TERMINAL
XAA-PRO-LYS
N-METHYLTRANSFERASE
1

(Homo sapiens) 		PF05891
(Methyltransf_PK) 		5 GLY A  69
GLY A  71
ILE A  92
HIS A 140
LEU A 141
 SAH  A 301 (-3.9A)
SAH  A 301 (-3.1A)
SAH  A 301 (-3.9A)
SAH  A 301 (-3.8A)
None
 0.56A 4mwzA-5e1bA:
18.0		 4mwzA-5e1bA:
23.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5e72 N2,
N2-DIMETHYLGUANOSINE
TRNA
METHYLTRANSFERASE

(Thermococcus
kodakarensis) 		PF01170
(UPF0020)
PF02926
(THUMP) 		5 ILE A 163
GLY A 189
ILE A 209
MET A 213
LEU A 271
 SAM  A 400 ( 4.1A)
SAM  A 400 (-3.3A)
SAM  A 400 (-3.9A)
SAM  A 400 (-4.3A)
None
 0.95A 4mwzA-5e72A:
14.4		 4mwzA-5e72A:
24.86
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.
5eqi SOLUTE CARRIER
FAMILY 2,
FACILITATED GLUCOSE
TRANSPORTER MEMBER 1

(Homo sapiens) 		PF00083
(Sugar_tr) 		5 ILE A 168
GLY A 312
GLY A 314
ILE A 372
ILE A 369
 None
 1.13A 4mwzA-5eqiA:
undetectable		 4mwzA-5eqiA:
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.
5g2c CHLORIDE PUMPING
RHODOPSIN

(Nonlabens
marinus) 		PF01036
(Bac_rhodopsin) 		5 GLY A 139
GLY A 142
ILE A 137
ILE A 136
SER A 160
 RET  A1273 ( 3.7A)
None
OLA  A1276 ( 4.4A)
None
RET  A1273 (-3.3A)
 1.07A 4mwzA-5g2cA:
undetectable		 4mwzA-5g2cA:
20.53
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.
5hk8 PROBABLE
PHEOPHORBIDASE

(Arabidopsis
thaliana) 		PF12697
(Abhydrolase_6) 		5 TYR A 205
GLY A  85
GLY A  90
ILE A 108
LEU A 249
 None
 1.11A 4mwzA-5hk8A:
undetectable		 4mwzA-5hk8A:
22.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5mc5 XAA-PRO DIPEPTIDASE

(Homo sapiens) 		no annotation 5 GLY A 447
ILE A 418
ARG A 265
SER A 251
LEU A 254
 None
None
None
None
PRO  A 504 (-4.5A)
 1.13A 4mwzA-5mc5A:
undetectable		 4mwzA-5mc5A:
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.
5mrt LYTIC ENDOPEPTIDASE
PREPROENZYME

(Lysobacter sp.
XL1) 		no annotation 6 ILE A   7
GLY A  24
GLY A   6
ILE A 154
ILE A 191
LEU A 202
 None
 1.31A 4mwzA-5mrtA:
undetectable		 4mwzA-5mrtA:
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.
5t77 PUTATIVE LIPID II
FLIPPASE MURJ

(Thermosipho
africanus) 		PF03023
(MVIN) 		5 ILE A 160
GLY A 183
GLY A 187
ARG A  24
LEU A 171
 OLC  A 527 ( 4.7A)
OLC  A 525 ( 3.3A)
None
CL  A 501 ( 4.8A)
OLC  A 525 ( 3.9A)
 1.11A 4mwzA-5t77A:
undetectable		 4mwzA-5t77A:
20.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ver KYNURENINE--OXOGLUTA
RATE TRANSAMINASE 3

(Mus musculus) 		no annotation 5 GLY A 222
GLY A 370
ILE A 374
ILE A 375
SER A 191
 None
 1.07A 4mwzA-5verA:
3.7		 4mwzA-5verA:
23.37
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.
5ver KYNURENINE--OXOGLUTA
RATE TRANSAMINASE 3

(Mus musculus) 		no annotation 5 GLY A 222
GLY A 371
ILE A 374
ILE A 375
SER A 191
 None
 1.05A 4mwzA-5verA:
3.7		 4mwzA-5verA:
23.37
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.
5vws CYTOCHROME P450

(Thermobispora
bispora) 		PF00067
(p450) 		5 ILE A 239
GLY A 346
GLY A 350
ILE A  99
LEU A 140
 None
HEM  A 401 ( 3.1A)
None
None
None
 1.12A 4mwzA-5vwsA:
undetectable		 4mwzA-5vwsA:
18.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5wp4 PHOSPHOETHANOLAMINE
N-METHYLTRANSFERASE
1

(Arabidopsis
thaliana) 		no annotation 6 TYR A 246
GLY A 290
GLY A 292
MET A 317
ARG A 355
HIS A 360
 SAH  A 703 ( 4.0A)
SAH  A 703 (-4.0A)
SAH  A 703 ( 3.7A)
SAH  A 703 (-3.8A)
None
SAH  A 703 (-4.0A)
 0.57A 4mwzA-5wp4A:
37.8		 4mwzA-5wp4A:
29.44
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5wp5 PHOSPHOMETHYLETHANOL
AMINE
N-METHYLTRANSFERASE
2

(Arabidopsis
thaliana) 		no annotation 5 GLY A 290
GLY A 292
MET A 317
ARG A 355
HIS A 360
 SAH  A 501 (-3.8A)
SAH  A 501 (-3.6A)
SAH  A 501 (-4.0A)
None
SAH  A 501 (-4.0A)
 0.61A 4mwzA-5wp5A:
33.6		 4mwzA-5wp5A:
31.56
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.
6d6q EXOSOME COMPLEX
COMPONENT RRP4

(Homo sapiens) 		no annotation 5 ILE H 141
GLY H 218
GLY H 164
MET H 113
ILE H 220
 None
 1.13A 4mwzA-6d6qH:
undetectable		 4mwzA-6d6qH:
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.
6f0k POLYSULPHIDE
REDUCTASE NRFD

(Rhodothermus
marinus) 		no annotation 5 ILE C  95
GLY C  96
ILE C 102
MET C 124
ILE C 105
 None
 1.11A 4mwzA-6f0kC:
undetectable		 4mwzA-6f0kC:
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.
1bdb CIS-BIPHENYL-2,3-DIH
YDRODIOL-2,3-DEHYDRO
GENASE

(Pseudomonas sp.) 		PF00106
(adh_short) 		3 SER A 189
ASP A  36
ASP A  59
 NAD  A 300 (-2.5A)
NAD  A 300 (-2.7A)
NAD  A 300 (-3.2A)
 0.92A 4mwzA-1bdbA:
7.0		 4mwzA-1bdbA:
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.
1e5d RUBREDOXIN:OXYGEN
OXIDOREDUCTASE

(Desulfovibrio
gigas) 		PF00258
(Flavodoxin_1)
PF00753
(Lactamase_B) 		3 SER A  29
ASP A  83
ASP A  49
 None
FEO  A 404 (-2.2A)
None
 0.77A 4mwzA-1e5dA:
undetectable		 4mwzA-1e5dA:
20.10
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.
1ekz MATERNAL EFFECT
PROTEIN (STAUFEN)

(Drosophila
melanogaster) 		PF00035
(dsrm) 		3 SER A  11
ASP A   5
ASP A   2
 None
 0.81A 4mwzA-1ekzA:
undetectable		 4mwzA-1ekzA:
17.43
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.
1h1y D-RIBULOSE-5-PHOSPHA
TE 3-EPIMERASE

(Oryza sativa) 		PF00834
(Ribul_P_3_epim) 		3 SER A 118
ASP A  67
ASP A  33
 None
 0.71A 4mwzA-1h1yA:
undetectable		 4mwzA-1h1yA:
19.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1hlg LIPASE, GASTRIC

(Homo sapiens) 		PF00561
(Abhydrolase_1) 		3 SER A 281
ASP A 331
ASP A 324
 None
 0.68A 4mwzA-1hlgA:
2.2		 4mwzA-1hlgA:
21.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1hpg GLUTAMIC ACID
SPECIFIC PROTEASE

(Streptomyces
griseus) 		no annotation 3 SER A  43
ASP A 102
ASP A 173
 None
 0.90A 4mwzA-1hpgA:
undetectable		 4mwzA-1hpgA:
18.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1j6u UDP-N-ACETYLMURAMATE
-ALANINE LIGASE MURC

(Thermotoga
maritima) 		PF01225
(Mur_ligase)
PF02875
(Mur_ligase_C)
PF08245
(Mur_ligase_M) 		3 SER A 161
ASP A 111
ASP A 323
 None
 0.92A 4mwzA-1j6uA:
5.0		 4mwzA-1j6uA:
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.
1k72 ENDOGLUCANASE 9G

([Clostridium]
cellulolyticum) 		PF00759
(Glyco_hydro_9)
PF00942
(CBM_3) 		3 SER A 339
ASP A 287
ASP A 280
 None
 0.90A 4mwzA-1k72A:
undetectable		 4mwzA-1k72A:
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.
1k8q TRIACYLGLYCEROL
LIPASE, GASTRIC

(Canis lupus) 		PF00561
(Abhydrolase_1) 		3 SER A 281
ASP A 331
ASP A 324
 None
 0.76A 4mwzA-1k8qA:
undetectable		 4mwzA-1k8qA:
20.47
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.
1kr5 PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE

(Homo sapiens) 		PF01135
(PCMT) 		3 SER A  59
ASP A 109
ASP A 141
 SAH  A 300 (-3.7A)
SAH  A 300 (-2.9A)
SAH  A 300 (-3.7A)
 0.71A 4mwzA-1kr5A:
9.5		 4mwzA-1kr5A:
22.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1nbw GLYCEROL DEHYDRATASE
REACTIVASE ALPHA
SUBUNIT

(Klebsiella
pneumoniae) 		PF08841
(DDR) 		3 SER A 561
ASP A 422
ASP A 333
 None
 0.88A 4mwzA-1nbwA:
undetectable		 4mwzA-1nbwA:
17.95
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.
1nhc POLYGALACTURONASE I

(Aspergillus
niger) 		PF00295
(Glyco_hydro_28) 		3 SER A 301
ASP A 288
ASP A 327
 None
 0.82A 4mwzA-1nhcA:
undetectable		 4mwzA-1nhcA:
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.
1ss6 NSFL1 COFACTOR P47

(Homo sapiens) 		PF08059
(SEP) 		3 SER A   2
ASP A  26
ASP A  66
 None
 0.81A 4mwzA-1ss6A:
undetectable		 4mwzA-1ss6A:
14.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1sxj ACTIVATOR 1 95 KDA
SUBUNIT

(Saccharomyces
cerevisiae) 		PF00004
(AAA)
PF08519
(RFC1) 		3 SER A 540
ASP A 553
ASP A 560
 None
 0.73A 4mwzA-1sxjA:
undetectable		 4mwzA-1sxjA:
19.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1uuo DIHYDROOROTATE
DEHYDROGENASE

(Rattus rattus) 		PF01180
(DHO_dh) 		3 SER A 151
ASP A  99
ASP A 106
 None
 0.90A 4mwzA-1uuoA:
undetectable		 4mwzA-1uuoA:
19.03
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.
1xog NEURAMINIDASE

(Influenza A
virus) 		PF00064
(Neur) 		3 SER A 247
ASP A 295
ASP A 340
 None
 0.73A 4mwzA-1xogA:
undetectable		 4mwzA-1xogA:
19.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1yd9 CORE HISTONE
MACRO-H2A.1

(Rattus
norvegicus) 		PF01661
(Macro) 		3 SER A 165
ASP A  34
ASP A  32
 None
 0.86A 4mwzA-1yd9A:
undetectable		 4mwzA-1yd9A:
22.30
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.
1z6r MLC PROTEIN

(Escherichia
coli) 		PF00480
(ROK) 		3 SER A  89
ASP A 195
ASP A 221
 None
 0.63A 4mwzA-1z6rA:
undetectable		 4mwzA-1z6rA:
20.99
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.
2aaa ALPHA-AMYLASE

(Aspergillus
niger) 		PF00128
(Alpha-amylase)
PF09260
(DUF1966) 		3 SER A 278
ASP A 239
ASP A 232
 None
 0.70A 4mwzA-2aaaA:
undetectable		 4mwzA-2aaaA:
19.86
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.
2e7z ACETYLENE HYDRATASE
AHY

(Pelobacter
acetylenicus) 		PF00384
(Molybdopterin)
PF01568
(Molydop_binding) 		3 SER A 157
ASP A 298
ASP A 711
 None
 0.79A 4mwzA-2e7zA:
undetectable		 4mwzA-2e7zA:
17.61
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.
2f53 T-CELL RECEPTOR,
ALPHA CHAIN

(Homo sapiens) 		PF07686
(V-set)
PF09291
(DUF1968) 		3 SER D  84
ASP D 164
ASP D 169
 None
 0.75A 4mwzA-2f53D:
undetectable		 4mwzA-2f53D:
19.15
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.
2f9t PANTOTHENATE KINASE

(Pseudomonas
aeruginosa) 		PF03309
(Pan_kinase) 		3 SER A  10
ASP A 121
ASP A 129
 None
 0.91A 4mwzA-2f9tA:
undetectable		 4mwzA-2f9tA:
22.49
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.
2gu2 ASPA PROTEIN

(Rattus
norvegicus) 		PF04952
(AstE_AspA) 		3 SER A 309
ASP A 109
ASP A 106
 None
 0.91A 4mwzA-2gu2A:
undetectable		 4mwzA-2gu2A:
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.
2gzx PUTATIVE TATD
RELATED DNASE

(Staphylococcus
aureus) 		PF01026
(TatD_DNase) 		3 SER A 156
ASP A  96
ASP A 100
 None
 0.92A 4mwzA-2gzxA:
undetectable		 4mwzA-2gzxA:
24.42
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.
2hlp MALATE DEHYDROGENASE

(Haloarcula
marismortui) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		3 SER A 139
ASP A  53
ASP A  54
 None
 0.73A 4mwzA-2hlpA:
6.0		 4mwzA-2hlpA:
21.50
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.
2id0 EXORIBONUCLEASE 2

(Escherichia
coli) 		PF00575
(S1)
PF00773
(RNB)
PF08206
(OB_RNB) 		3 SER A 202
ASP A 209
ASP A 504
 None
MN  A1001 (-3.9A)
None
 0.83A 4mwzA-2id0A:
undetectable		 4mwzA-2id0A:
16.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ie8 PHOSPHOGLYCERATE
KINASE

(Thermus
caldophilus) 		PF00162
(PGK) 		3 SER A 350
ASP A 291
ASP A 262
 None
 0.83A 4mwzA-2ie8A:
3.2		 4mwzA-2ie8A:
19.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2jar 5'(3')-DEOXYRIBONUCL
EOTIDASE

(Mus musculus) 		PF06941
(NT5C) 		3 SER A  22
ASP A 147
ASP A 149
 None
MG  A1201 (-2.6A)
None
 0.91A 4mwzA-2jarA:
undetectable		 4mwzA-2jarA:
20.30
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.
2mah PROTEIN SMOOTHENED

(Drosophila
melanogaster) 		PF01392
(Fz) 		3 SER A  12
ASP A  50
ASP A  53
 None
 0.78A 4mwzA-2mahA:
undetectable		 4mwzA-2mahA:
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.
2nrh TRANSCRIPTIONAL
ACTIVATOR, PUTATIVE,
BAF FAMILY

(Campylobacter
jejuni) 		PF03309
(Pan_kinase) 		3 SER A   9
ASP A  89
ASP A  97
 SO4  A 218 (-4.5A)
None
None
 0.83A 4mwzA-2nrhA:
undetectable		 4mwzA-2nrhA:
24.19
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.
2ntb PECTINESTERASE A

(Dickeya
dadantii) 		PF01095
(Pectinesterase) 		3 SER A 235
ASP A 178
ASP A 151
 None
 0.62A 4mwzA-2ntbA:
undetectable		 4mwzA-2ntbA:
22.95
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.
2o04 PECTATE LYASE

(Bacillus
subtilis) 		PF00544
(Pec_lyase_C) 		3 SER A 211
ASP A 161
ASP A  63
 None
 0.79A 4mwzA-2o04A:
undetectable		 4mwzA-2o04A:
21.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2p9n ACTIN-RELATED
PROTEIN 2/3 COMPLEX
SUBUNIT 1B

(Bos taurus) 		PF00400
(WD40) 		3 SER C  64
ASP C  59
ASP C 149
 None
 0.90A 4mwzA-2p9nC:
undetectable		 4mwzA-2p9nC:
22.49
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.
2qom SERINE PROTEASE ESPP

(Escherichia
coli) 		PF03797
(Autotransporter) 		3 SER A1179
ASP A1243
ASP A1058
 None
 0.83A 4mwzA-2qomA:
undetectable		 4mwzA-2qomA:
21.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2v4n MULTIFUNCTIONAL
PROTEIN SUR E

(Salmonella
enterica) 		PF01975
(SurE) 		3 SER A 104
ASP A 213
ASP A 218
 PO4  A1257 ( 3.9A)
None
None
 0.86A 4mwzA-2v4nA:
undetectable		 4mwzA-2v4nA:
20.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2vdw VACCINIA VIRUS
CAPPING ENZYME D1
SUBUNIT

(Vaccinia virus) 		PF03291
(Pox_MCEL) 		3 SER A 684
ASP A 620
ASP A 624
 None
SAH  A1846 (-2.6A)
None
 0.77A 4mwzA-2vdwA:
15.7		 4mwzA-2vdwA:
23.24
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.
2yhe SEC-ALKYL SULFATASE

(Pseudomonas sp.
DSM 6611) 		PF00753
(Lactamase_B)
PF14863
(Alkyl_sulf_dimr)
PF14864
(Alkyl_sulf_C) 		3 SER A 294
ASP A 148
ASP A 131
 None
 0.81A 4mwzA-2yheA:
undetectable		 4mwzA-2yheA:
17.04
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.
2zwa LEUCINE CARBOXYL
METHYLTRANSFERASE 2

(Saccharomyces
cerevisiae) 		PF04072
(LCM)
PF13418
(Kelch_4) 		3 SER A  34
ASP A 146
ASP A 196
 SAH  A 801 (-3.6A)
SAH  A 801 (-2.9A)
SAH  A 801 (-4.1A)
 0.82A 4mwzA-2zwaA:
12.2		 4mwzA-2zwaA:
16.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3enq RIBOSE-5-PHOSPHATE
ISOMERASE A

(Vibrio
vulnificus) 		PF06026
(Rib_5-P_isom_A) 		3 SER A  30
ASP A  84
ASP A 170
 None
 0.71A 4mwzA-3enqA:
2.4		 4mwzA-3enqA:
22.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3h0g DNA-DIRECTED RNA
POLYMERASE II
SUBUNIT RPB1

(Schizosaccharomyces
pombe) 		PF00623
(RNA_pol_Rpb1_2)
PF04983
(RNA_pol_Rpb1_3)
PF04990
(RNA_pol_Rpb1_7)
PF04992
(RNA_pol_Rpb1_6)
PF04997
(RNA_pol_Rpb1_1)
PF04998
(RNA_pol_Rpb1_5)
PF05000
(RNA_pol_Rpb1_4) 		3 SER A1407
ASP A 853
ASP A 868
 None
 0.51A 4mwzA-3h0gA:
undetectable		 4mwzA-3h0gA:
11.30
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.
3hsy GLUTAMATE RECEPTOR 2

(Rattus
norvegicus) 		PF01094
(ANF_receptor) 		3 SER A  75
ASP A 134
ASP A 193
 None
 0.87A 4mwzA-3hsyA:
undetectable		 4mwzA-3hsyA:
20.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3kd6 CARBOHYDRATE KINASE,
PFKB FAMILY

(Chlorobaculum
tepidum) 		PF00294
(PfkB) 		3 SER A  29
ASP A  12
ASP A  98
 None
AMP  A 509 (-2.8A)
None
 0.76A 4mwzA-3kd6A:
3.3		 4mwzA-3kd6A:
20.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3mx3 SUSD HOMOLOG

(Bacteroides
fragilis) 		PF12771
(SusD-like_2) 		3 SER A  55
ASP A  61
ASP A 438
 None
MG  A 601 ( 2.4A)
None
 0.81A 4mwzA-3mx3A:
undetectable		 4mwzA-3mx3A:
20.32
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.
3pls MACROPHAGE-STIMULATI
NG PROTEIN RECEPTOR

(Homo sapiens) 		PF07714
(Pkinase_Tyr) 		3 SER A1117
ASP A1226
ASP A1168
 None
MG  A   1 ( 3.2A)
ANP  A1358 (-4.1A)
 0.76A 4mwzA-3plsA:
undetectable		 4mwzA-3plsA:
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.
3s5u PUTATIVE
UNCHARACTERIZED
PROTEIN

(Enterococcus
faecalis) 		PF09711
(Cas_Csn2) 		3 SER A 159
ASP A  82
ASP A  89
 None
 0.73A 4mwzA-3s5uA:
undetectable		 4mwzA-3s5uA:
24.65
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.
3swo GLUTARYL-COA
DEHYDROGENASE

(Mycolicibacterium
smegmatis) 		PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M)
PF02771
(Acyl-CoA_dh_N) 		3 SER A  53
ASP A  98
ASP A 268
 None
 0.78A 4mwzA-3swoA:
undetectable		 4mwzA-3swoA:
21.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3u0a ACYL-COA
THIOESTERASE II
TESB2

(Mycobacterium
marinum) 		PF13622
(4HBT_3) 		3 SER A 166
ASP A 236
ASP A 117
 None
 0.76A 4mwzA-3u0aA:
undetectable		 4mwzA-3u0aA:
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.
3ubo ADENOSINE KINASE

(Sinorhizobium
meliloti) 		PF00294
(PfkB) 		3 SER A  57
ASP A  84
ASP A 107
 None
 0.80A 4mwzA-3uboA:
3.8		 4mwzA-3uboA:
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.
3uw0 PECTINESTERASE

(Yersinia
enterocolitica) 		PF01095
(Pectinesterase) 		3 SER A 233
ASP A 177
ASP A 150
 None
 0.62A 4mwzA-3uw0A:
undetectable		 4mwzA-3uw0A:
20.60
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.
3va8 PROBABLE DEHYDRATASE

(Fusarium
graminearum) 		PF13378
(MR_MLE_C) 		3 SER A 320
ASP A  19
ASP A 162
 None
 0.85A 4mwzA-3va8A:
undetectable		 4mwzA-3va8A:
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.
3vzi CRISPR-ASSOCIATED
PROTEIN CAS5, DVULG
SUBTYPE

(Xanthomonas
oryzae) 		PF09704
(Cas_Cas5d) 		3 SER A   2
ASP A 168
ASP A 170
 None
 0.91A 4mwzA-3vziA:
undetectable		 4mwzA-3vziA:
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.
4axz PUTATIVE ANTIGEN P35

(Borreliella
burgdorferi) 		PF05714
(Borrelia_lipo_1) 		3 SER A 150
ASP A 239
ASP A 246
 None
 0.73A 4mwzA-4axzA:
undetectable		 4mwzA-4axzA:
22.82
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.
4b2f PUTATIVE ANTIGEN P35

(Borreliella
burgdorferi) 		PF05714
(Borrelia_lipo_1) 		3 SER A 150
ASP A 239
ASP A 246
 None
 0.82A 4mwzA-4b2fA:
undetectable		 4mwzA-4b2fA:
20.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4b9d SERINE/THREONINE-PRO
TEIN KINASE NEK1

(Homo sapiens) 		PF00069
(Pkinase) 		3 SER A  69
ASP A 146
ASP A 128
 None
 0.63A 4mwzA-4b9dA:
undetectable		 4mwzA-4b9dA:
24.25
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.
4d6y BACTERIAL
REGULATORY, FIS
FAMILY PROTEIN

(Brucella
abortus) 		PF00072
(Response_reg) 		3 SER A  59
ASP A   9
ASP A  16
 None
MG  A1126 ( 4.1A)
None
 0.91A 4mwzA-4d6yA:
3.2		 4mwzA-4d6yA:
20.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4euk HISTIDINE KINASE 5
HISTIDINE-CONTAINING
PHOSPHOTRANSFER
PROTEIN 1

(Arabidopsis
thaliana;
Arabidopsis
thaliana) 		PF00072
(Response_reg)
PF01627
(Hpt) 		3 SER B  87
ASP A 785
ASP A 835
 None
MG  A1001 (-2.5A)
None
 0.92A 4mwzA-4eukB:
undetectable		 4mwzA-4eukB:
21.03
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.
4ewt PEPTIDASE,
M20/M25/M40 FAMILY

(Staphylococcus
aureus) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		3 SER A 332
ASP A  78
ASP A 106
 None
MN  A 402 ( 4.4A)
None
 0.51A 4mwzA-4ewtA:
undetectable		 4mwzA-4ewtA:
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.
4i9c RESPONSE REGULATOR
ASPARTATE
PHOSPHATASE F

(Bacillus
subtilis) 		PF12895
(ANAPC3)
PF13424
(TPR_12) 		3 SER A 119
ASP A  89
ASP A  83
 None
 0.87A 4mwzA-4i9cA:
undetectable		 4mwzA-4i9cA:
21.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ine PROTEIN PMT-2

(Caenorhabditis
elegans) 		PF08241
(Methyltransf_11) 		3 SER A   3
ASP A 158
ASP A 109
 None
 0.85A 4mwzA-4ineA:
36.3		 4mwzA-4ineA:
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.
4ine PROTEIN PMT-2

(Caenorhabditis
elegans) 		PF08241
(Methyltransf_11) 		3 SER A 205
ASP A 254
ASP A 281
 SAH  A 501 (-2.7A)
SAH  A 501 (-2.6A)
SAH  A 501 (-3.5A)
 0.48A 4mwzA-4ineA:
36.3		 4mwzA-4ineA:
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.
4iws PA0254

(Pseudomonas
aeruginosa) 		PF01977
(UbiD) 		3 SER A   4
ASP A  20
ASP A  73
 None
 0.80A 4mwzA-4iwsA:
undetectable		 4mwzA-4iwsA:
15.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4kri PHOSPHOLETHANOLAMINE
N-METHYLTRANSFERASE
2

(Haemonchus
contortus) 		PF08241
(Methyltransf_11) 		3 SER A 201
ASP A 250
ASP A 277
 SAH  A 701 (-2.7A)
SAH  A 701 (-2.7A)
SAH  A 701 (-3.4A)
 0.52A 4mwzA-4kriA:
36.3		 4mwzA-4kriA:
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.
4m3c LECTIN BETA CHAIN

(Butea
monosperma) 		PF00139
(Lectin_legB) 		3 SER B 149
ASP B 137
ASP B 140
 None
MN  B 302 ( 2.7A)
None
 0.70A 4mwzA-4m3cB:
undetectable		 4mwzA-4m3cB:
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.
4m4r EPHRIN TYPE-A
RECEPTOR 4

(Homo sapiens) 		PF00041
(fn3)
PF01404
(Ephrin_lbd) 		3 SER A 224
ASP A 172
ASP A 146
 None
 0.80A 4mwzA-4m4rA:
undetectable		 4mwzA-4m4rA:
19.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4mna LRR RECEPTOR-LIKE
SERINE/THREONINE-PRO
TEIN KINASE FLS2

(Arabidopsis
thaliana) 		PF00560
(LRR_1)
PF08263
(LRRNT_2)
PF13516
(LRR_6)
PF13855
(LRR_8) 		3 SER A 536
ASP A 605
ASP A 655
 None
NAG  A 902 ( 4.6A)
NAG  A 902 (-3.8A)
 0.83A 4mwzA-4mnaA:
undetectable		 4mwzA-4mnaA:
18.89
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4mwz PHOSPHOETHANOLAMINE
N-METHYLTRANSFERASE,
PUTATIVE

(Plasmodium
vivax) 		PF13649
(Methyltransf_25) 		3 SER A  34
ASP A  82
ASP A 107
 SAM  A 301 (-2.4A)
SAM  A 301 (-2.8A)
SAM  A 301 (-3.5A)
 0.00A 4mwzA-4mwzA:
47.3		 4mwzA-4mwzA:
100.00
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.
4mx8 PERIPLASMIC BINDING
PROTEIN

(Xylanimonas
cellulosilytica) 		PF01497
(Peripla_BP_2) 		3 SER A 195
ASP A 201
ASP A  30
 None
 0.75A 4mwzA-4mx8A:
undetectable		 4mwzA-4mx8A:
22.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ofz TREHALOSE-PHOSPHATAS
E

(Brugia malayi) 		no annotation 3 SER A 277
ASP A 215
ASP A 220
 None
 0.88A 4mwzA-4ofzA:
undetectable		 4mwzA-4ofzA:
21.22
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.
4qme AMINOPEPTIDASE N

(Neisseria
meningitidis) 		PF01433
(Peptidase_M1)
PF11940
(DUF3458)
PF17432
(DUF3458_C) 		3 SER A 782
ASP A 283
ASP A 275
 None
 0.83A 4mwzA-4qmeA:
undetectable		 4mwzA-4qmeA:
16.42
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.
4qtf L,D-TRANSPEPTIDASE
LDTB

(Mycobacterium
tuberculosis) 		PF03734
(YkuD) 		3 SER A  65
ASP A  76
ASP A 232
 MLD  A 501 (-4.7A)
None
None
 0.87A 4mwzA-4qtfA:
undetectable		 4mwzA-4qtfA:
18.62
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4r6w PHOSPHOETHANOLAMINE
N-METHYLTRANSFERASE

(Plasmodium
falciparum) 		PF13649
(Methyltransf_25) 		3 SER A  37
ASP A  85
ASP A 110
 SAH  A 302 (-2.5A)
SAH  A 302 (-2.6A)
SAH  A 302 (-3.6A)
 0.32A 4mwzA-4r6wA:
41.1		 4mwzA-4r6wA:
63.77
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.
4rhb LPS-ASSEMBLY PROTEIN
LPTD

(Escherichia
coli) 		PF04453
(OstA_C) 		3 SER A 588
ASP A 629
ASP A 633
 None
 0.90A 4mwzA-4rhbA:
undetectable		 4mwzA-4rhbA:
18.27
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.
4ru0 PUTATIVE
BRANCHED-CHAIN AMINO
ACID ABC
TRANSPORTER,
PERIPLASMIC
BRANCHED-CHAIN AMINO
ACID-BINDING PROTEIN

(Pseudomonas
protegens) 		PF13458
(Peripla_BP_6) 		3 SER A  45
ASP A 272
ASP A 264
 None
 0.88A 4mwzA-4ru0A:
3.9		 4mwzA-4ru0A:
18.69
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.
4tma DNA GYRASE SUBUNIT B
DNA GYRASE INHIBITOR
YACG

(Escherichia
coli;
Escherichia
coli) 		PF00986
(DNA_gyraseB_C)
PF01751
(Toprim)
PF03884
(YacG) 		3 SER I  50
ASP B 502
ASP B 426
 None
ZN  B1001 (-3.3A)
None
 0.87A 4mwzA-4tmaI:
undetectable		 4mwzA-4tmaI:
13.18
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.
4toq CLASS III CHITINASE

(Punica granatum) 		PF00704
(Glyco_hydro_18) 		3 SER A 145
ASP A 120
ASP A  71
 None
 0.91A 4mwzA-4toqA:
undetectable		 4mwzA-4toqA:
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.
4um8 INTEGRIN ALPHA-V

(Homo sapiens) 		PF01839
(FG-GAP)
PF08441
(Integrin_alpha2) 		3 SER A  29
ASP A 167
ASP A 237
 None
 0.86A 4mwzA-4um8A:
undetectable		 4mwzA-4um8A:
17.74
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.
4yai C
ALPHA-DEHYDROGENASE

(Sphingobium sp.
SYK-6) 		PF00106
(adh_short) 		3 SER A 193
ASP A  36
ASP A  64
 NAI  A 500 (-2.7A)
NAI  A 500 (-2.2A)
NAI  A 500 (-3.0A)
 0.91A 4mwzA-4yaiA:
6.9		 4mwzA-4yaiA:
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.
5amo NOELIN

(Mus musculus) 		PF02191
(OLF) 		3 SER A 353
ASP A 453
ASP A 360
 None
 0.90A 4mwzA-5amoA:
undetectable		 4mwzA-5amoA:
20.98
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.
5b7i CRISPR-ASSOCIATED
NUCLEASE/HELICASE
CAS3 SUBTYPE
I-F/YPEST

(Pseudomonas
aeruginosa) 		no annotation 3 SER A 821
ASP A 580
ASP A 576
 None
 0.86A 4mwzA-5b7iA:
3.1		 4mwzA-5b7iA:
11.98
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.
5dkx ALPHA
GLUCOSIDASE-LIKE
PROTEIN

(Chaetomium
thermophilum) 		PF01055
(Glyco_hydro_31)
PF13802
(Gal_mutarotas_2)
PF17137
(DUF5110) 		3 SER A 170
ASP A 189
ASP A 328
 None
 0.89A 4mwzA-5dkxA:
undetectable		 4mwzA-5dkxA:
13.99
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.
5do7 ATP-BINDING CASSETTE
SUB-FAMILY G MEMBER
5
ATP-BINDING CASSETTE
SUB-FAMILY G MEMBER
8

(Homo sapiens;
Homo sapiens) 		PF00005
(ABC_tran)
PF01061
(ABC2_membrane)
PF00005
(ABC_tran)
PF01061
(ABC2_membrane) 		3 SER B 214
ASP A 308
ASP A 303
 None
 0.75A 4mwzA-5do7B:
undetectable		 4mwzA-5do7B:
16.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5exr DNA POLYMERASE ALPHA
SUBUNIT B

(Homo sapiens) 		PF04042
(DNA_pol_E_B)
PF08418
(Pol_alpha_B_N) 		3 SER D 205
ASP D 521
ASP D 215
 None
 0.82A 4mwzA-5exrD:
undetectable		 4mwzA-5exrD:
18.57
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.
5fw4 DYE-DECOLORIZING
PEROXIDASE TFU_3078

(Thermobifida
fusca) 		PF04261
(Dyp_perox) 		3 SER A 177
ASP A 331
ASP A 326
 None
 0.79A 4mwzA-5fw4A:
undetectable		 4mwzA-5fw4A:
17.65
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.
5hax NUCLEOPORIN NUP170

(Chaetomium
thermophilum) 		PF08801
(Nucleoporin_N) 		3 SER A 382
ASP A 478
ASP A 487
 None
 0.89A 4mwzA-5haxA:
undetectable		 4mwzA-5haxA:
16.76
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.
5hg0 PANTOTHENATE
SYNTHETASE

(Francisella
tularensis) 		PF02569
(Pantoate_ligase) 		3 SER A 180
ASP A 251
ASP A 150
 None
None
SAM  A 301 (-4.2A)
 0.75A 4mwzA-5hg0A:
2.3		 4mwzA-5hg0A:
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.
5i67 PHOSPHOENOLPYRUVATE
CARBOXYKINASE [GTP]

(Mycobacterium
tuberculosis) 		PF00821
(PEPCK_C)
PF17297
(PEPCK_N) 		3 SER A 199
ASP A 148
ASP A  33
 None
 0.82A 4mwzA-5i67A:
undetectable		 4mwzA-5i67A:
18.17
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.
5k69 L,D-TRANSPEPTIDASE 2

(Mycobacterium
tuberculosis) 		PF03734
(YkuD) 		3 SER A  65
ASP A  76
ASP A 232
 None
 0.78A 4mwzA-5k69A:
undetectable		 4mwzA-5k69A:
19.07
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.
5m09 SERINE/THREONINE-PRO
TEIN KINASE PKNI

(Mycobacterium
tuberculosis) 		PF00069
(Pkinase) 		3 SER A  44
ASP A 159
ASP A  96
 None
 0.91A 4mwzA-5m09A:
undetectable		 4mwzA-5m09A:
19.73
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.
5mvd DIHYDROOROTATE
DEHYDROGENASE
(QUINONE),
MITOCHONDRIAL

(Homo sapiens) 		PF01180
(DHO_dh) 		3 SER A 151
ASP A  99
ASP A 106
 None
 0.85A 4mwzA-5mvdA:
undetectable		 4mwzA-5mvdA:
20.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5t1p ABC TRANSPORTER,
PERIPLASMIC
SUBSTRATE-BINDING
PROTEIN

(Campylobacter
jejuni) 		PF13343
(SBP_bac_6) 		3 SER A 255
ASP A  90
ASP A  67
 None
None
GPE  A 402 ( 4.5A)
 0.92A 4mwzA-5t1pA:
undetectable		 4mwzA-5t1pA:
24.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5whz ANTI-HIV CODV-FAB
HEAVY CHAIN
ANTI-HIV CODV-FAB
LIGHT CHAIN

(Homo sapiens;
Homo sapiens) 		no annotation
no annotation 		3 SER H  65
ASP L 209
ASP L 143
 None
 0.86A 4mwzA-5whzH:
undetectable		 4mwzA-5whzH:
20.47
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.
5wp4 PHOSPHOETHANOLAMINE
N-METHYLTRANSFERASE
1

(Arabidopsis
thaliana) 		no annotation 3 SER A 264
ASP A 312
ASP A 338
 SAH  A 703 (-2.6A)
SAH  A 703 (-2.6A)
SAH  A 703 (-3.3A)
 0.20A 4mwzA-5wp4A:
37.8		 4mwzA-5wp4A:
29.44
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5wp5 PHOSPHOMETHYLETHANOL
AMINE
N-METHYLTRANSFERASE
2

(Arabidopsis
thaliana) 		no annotation 3 SER A 264
ASP A 312
ASP A 338
 SAH  A 501 (-2.6A)
SAH  A 501 (-2.8A)
SAH  A 501 (-3.4A)
 0.20A 4mwzA-5wp5A:
33.6		 4mwzA-5wp5A:
31.56
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.
5y3r DNA-DEPENDENT
PROTEIN KINASE
CATALYTIC SUBUNIT

(Homo sapiens) 		PF00454
(PI3_PI4_kinase)
PF02259
(FAT)
PF02260
(FATC)
PF08163
(NUC194) 		3 SER C 728
ASP C1022
ASP C1015
 None
 0.86A 4mwzA-5y3rC:
undetectable		 4mwzA-5y3rC:
5.32
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.
6ans UNCHARACTERIZED
PROTEIN

(Burkholderia
cenocepacia) 		PF06742
(DUF1214) 		3 SER A 294
ASP A  87
ASP A 178
 None
 0.85A 4mwzA-6ansA:
undetectable		 4mwzA-6ansA:
19.55
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.
6br6 NEURAMINIDASE

(Influenza A
virus) 		no annotation 3 SER A 245
ASP A 293
ASP A 339
 None
 0.92A 4mwzA-6br6A:
undetectable		 4mwzA-6br6A:
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.
6eoj PROTEIN CFT1

(Saccharomyces
cerevisiae) 		no annotation 3 SER A 416
ASP A 421
ASP A  45
 None
 0.91A 4mwzA-6eojA:
undetectable		 4mwzA-6eojA:
11.84
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.
6eoj PROTEIN CFT1

(Saccharomyces
cerevisiae) 		no annotation 3 SER A 861
ASP A 877
ASP A  45
 None
 0.78A 4mwzA-6eojA:
undetectable		 4mwzA-6eojA:
11.84
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.
6epi EPSILON_1 ANTITOXIN
ZETA_1 TOXIN

(Neisseria
gonorrhoeae;
Neisseria
gonorrhoeae) 		no annotation
no annotation 		3 SER A   9
ASP B 225
ASP B 228
 None
 0.90A 4mwzA-6epiA:
undetectable		 4mwzA-6epiA:
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.
6fea NITROGENASE PROTEIN
ALPHA CHAIN

(Azotobacter
vinelandii) 		no annotation 3 SER A 261
ASP A 367
ASP A 383
 None
 0.82A 4mwzA-6feaA:
undetectable		 4mwzA-6feaA:
undetectable