SIMILAR PATTERNS OF AMINO ACIDS FOR 4FIA_A_0U9A601_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.
1c3x PENTOSYLTRANSFERASE

(Cellulomonas
sp.) 		PF01048
(PNP_UDP_1) 		5 PHE A  70
LEU A 100
ALA A  97
ALA A 122
THR A 125
 None
 1.26A 4fiaA-1c3xA:
0.0		 4fiaA-1c3xA:
20.65
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.
1e8t HEMAGGLUTININ-NEURAM
INIDASE

(Avian
avulavirus 1) 		PF00423
(HN) 		5 LEU A 561
PHE A 156
VAL A 563
ALA A 546
THR A 527
 None
 1.12A 4fiaA-1e8tA:
0.0		 4fiaA-1e8tA:
23.69
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.
1i7f HEAT SHOCK PROTEIN
33

(Escherichia
coli) 		PF01430
(HSP33) 		5 TYR A 145
LEU A 142
VAL A 115
ALA A  53
THR A  54
 None
 1.22A 4fiaA-1i7fA:
0.0		 4fiaA-1i7fA:
20.74
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.
1i7o 4-HYDROXYPHENYLACETA
TE DEGRADATION
BIFUNCTIONAL
ISOMERASE/DECARBOXYL
ASE

(Escherichia
coli) 		PF01557
(FAA_hydrolase) 		5 TYR A 378
LEU A 379
PHE A 226
VAL A 249
ARG A 288
 None
 1.26A 4fiaA-1i7oA:
0.0		 4fiaA-1i7oA:
24.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1jdz 5'-METHYLTHIOADENOSI
NE PHOSPHORYLASE

(Sulfolobus
solfataricus) 		PF01048
(PNP_UDP_1) 		5 LEU A  76
VAL A  17
ALA A  14
ALA A   8
THR A  39
 None
 1.13A 4fiaA-1jdzA:
undetectable		 4fiaA-1jdzA:
19.53
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.
1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT

(Escherichia
coli) 		PF00384
(Molybdopterin)
PF01568
(Molydop_binding)
PF04879
(Molybdop_Fe4S4) 		5 TYR A 290
LEU A 291
VAL A 287
THR A 404
THR A 397
 None
 1.04A 4fiaA-1kqfA:
0.0		 4fiaA-1kqfA:
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.
1lxy ARGININE DEIMINASE

(Mycoplasma
arginini) 		PF02274
(Amidinotransf) 		5 PHE A 292
VAL A 261
THR A 351
GLU A  16
THR A 275
 None
 1.17A 4fiaA-1lxyA:
0.0		 4fiaA-1lxyA:
22.02
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.
1o2d ALCOHOL
DEHYDROGENASE,
IRON-CONTAINING

(Thermotoga
maritima) 		PF00465
(Fe-ADH) 		5 LEU A  49
VAL A  91
ALA A  31
GLU A  55
THR A  56
 None
 1.24A 4fiaA-1o2dA:
undetectable		 4fiaA-1o2dA:
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.
1qs0 2-OXOISOVALERATE
DEHYDROGENASE
BETA-SUBUNIT

(Pseudomonas
putida) 		PF02779
(Transket_pyr)
PF02780
(Transketolase_C) 		5 VAL B 275
ARG B 218
ALA B 332
GLU B 240
ALA B 239
 None
 1.14A 4fiaA-1qs0B:
0.0		 4fiaA-1qs0B:
22.99
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.
1sxj ACTIVATOR 1 40 KDA
SUBUNIT

(Saccharomyces
cerevisiae) 		PF00004
(AAA)
PF08542
(Rep_fac_C) 		5 VAL C  93
ALA C 126
THR C 123
GLU C 118
ALA C 119
 None
None
None
AGS  C 803 ( 4.9A)
None
 1.25A 4fiaA-1sxjC:
undetectable		 4fiaA-1sxjC:
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.
1urd MALTOSE-BINDING
PROTEIN

(Alicyclobacillus
acidocaldarius) 		PF01547
(SBP_bac_1) 		5 LEU A 350
PHE A 346
VAL A 142
ALA A 120
THR A 123
 None
 1.19A 4fiaA-1urdA:
undetectable		 4fiaA-1urdA:
19.30
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.
1vbg PYRUVATE,ORTHOPHOSPH
ATE DIKINASE

(Zea mays) 		PF00391
(PEP-utilizers)
PF01326
(PPDK_N)
PF02896
(PEP-utilizers_C) 		5 LEU A 831
PHE A 768
VAL A 833
ALA A 820
ALA A 827
 None
 1.30A 4fiaA-1vbgA:
undetectable		 4fiaA-1vbgA:
19.19
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.
1vc2 GLYCERALDEHYDE
3-PHOSPHATE
DEHYDROGENASE

(Thermus
thermophilus) 		PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C) 		5 LEU A 161
VAL A 157
ARG A 247
THR A 296
GLU A 253
 None
 1.28A 4fiaA-1vc2A:
undetectable		 4fiaA-1vc2A:
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.
1wv2 THIAZOLE
BIOSYNTHESIS PROTEIN
THIG

(Pseudomonas
aeruginosa) 		PF05690
(ThiG) 		5 LEU A1131
PHE A1136
VAL A1106
ALA A1096
GLU A1088
 None
 1.25A 4fiaA-1wv2A:
undetectable		 4fiaA-1wv2A:
20.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1yd7 2-KETO
ACID:FERREDOXIN
OXIDOREDUCTASE
SUBUNIT ALPHA

(Pyrococcus
furiosus) 		PF01855
(POR_N) 		5 LEU A 175
VAL A 109
ALA A  25
GLU A 154
ALA A 155
 None
 1.25A 4fiaA-1yd7A:
undetectable		 4fiaA-1yd7A:
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.
1yw6 SUCCINYLGLUTAMATE
DESUCCINYLASE

(Escherichia
coli) 		PF04952
(AstE_AspA) 		5 PHE A 186
ARG A 250
ALA A 179
GLU A 170
THR A 174
 None
 1.29A 4fiaA-1yw6A:
undetectable		 4fiaA-1yw6A:
23.87
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.
2bgs ALDOSE REDUCTASE

(Hordeum vulgare) 		PF00248
(Aldo_ket_red) 		5 LEU A  83
VAL A  54
ALA A  45
GLU A  75
ALA A  73
 None
 1.23A 4fiaA-2bgsA:
undetectable		 4fiaA-2bgsA:
21.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2dhr FTSH

(Thermus
thermophilus) 		PF00004
(AAA)
PF01434
(Peptidase_M41) 		5 LEU A 569
VAL A 572
ALA A 423
GLU A 479
ALA A 478
 None
 1.18A 4fiaA-2dhrA:
undetectable		 4fiaA-2dhrA:
23.57
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.
2dkj SERINE
HYDROXYMETHYLTRANSFE
RASE

(Thermus
thermophilus) 		PF00464
(SHMT) 		5 PHE A  82
ALA A 202
THR A 227
GLU A 273
ALA A 274
 None
 1.23A 4fiaA-2dkjA:
undetectable		 4fiaA-2dkjA:
25.50
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.
2do7 CULLIN-4B

(Homo sapiens) 		PF10557
(Cullin_Nedd8) 		5 TYR A 856
LEU A 859
PHE A 861
VAL A 863
ALA A 835
 None
 1.30A 4fiaA-2do7A:
undetectable		 4fiaA-2do7A:
13.76
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.
2ehb CBL-INTERACTING
SERINE/THREONINE-PRO
TEIN KINASE 24

(Arabidopsis
thaliana) 		PF03822
(NAF) 		5 PHE D 416
ARG D 404
ALA D 358
GLU D 390
THR D 372
 None
 1.30A 4fiaA-2ehbD:
undetectable		 4fiaA-2ehbD:
15.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2f7n DNA-BINDING STRESS
RESPONSE PROTEIN,
DPS FAMILY

(Deinococcus
radiodurans) 		PF00210
(Ferritin) 		5 TYR A  52
LEU A  53
ALA A  62
THR A  64
ALA A 174
 None
 1.28A 4fiaA-2f7nA:
undetectable		 4fiaA-2f7nA:
19.44
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.
2i2w PHOSPHOHEPTOSE
ISOMERASE

(Escherichia
coli) 		PF13580
(SIS_2) 		5 TYR A 104
LEU A  48
ARG A 110
ALA A  63
THR A  67
 None
 1.08A 4fiaA-2i2wA:
undetectable		 4fiaA-2i2wA:
18.56
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.
2ibu ACETYL-COA
ACETYLTRANSFERASE

(Homo sapiens) 		PF00108
(Thiolase_N)
PF02803
(Thiolase_C) 		5 LEU A 309
ALA A  79
GLU A 234
ALA A  47
THR A  48
 None
 1.29A 4fiaA-2ibuA:
undetectable		 4fiaA-2ibuA:
23.95
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.
2iv2 FORMATE
DEHYDROGENASE H

(Escherichia
coli) 		PF00384
(Molybdopterin)
PF01568
(Molydop_binding)
PF04879
(Molybdop_Fe4S4) 		5 VAL X 469
ARG X  28
THR X   6
GLU X  30
ALA X  29
 None
 1.29A 4fiaA-2iv2X:
undetectable		 4fiaA-2iv2X:
20.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2jky HYPOXANTHINE-GUANINE
PHOSPHORIBOSYLTRANSF
ERASE

(Saccharomyces
cerevisiae) 		PF00156
(Pribosyltran) 		5 TYR A 178
LEU A 167
ALA A 122
ALA A 165
THR A 117
 None
None
None
None
5GP  A 300 (-3.7A)
 1.19A 4fiaA-2jkyA:
undetectable		 4fiaA-2jkyA:
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.
2ooe CLEAVAGE STIMULATION
FACTOR 77 KDA
SUBUNIT

(Mus musculus) 		PF05843
(Suf) 		5 TYR A  54
LEU A  57
PHE A  67
ARG A  56
GLU A  22
 None
 1.27A 4fiaA-2ooeA:
undetectable		 4fiaA-2ooeA:
22.42
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2q9g CYTOCHROME P450 46A1

(Homo sapiens) 		PF00067
(p450) 		9 PHE A  80
TYR A 109
LEU A 112
PHE A 121
VAL A 126
ALA A 302
THR A 306
ALA A 474
THR A 475
 None
None
None
None
HEM  A 505 ( 3.8A)
HEM  A 505 (-3.7A)
HEM  A 505 (-3.7A)
None
None
 0.87A 4fiaA-2q9gA:
65.8		 4fiaA-2q9gA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2q9g CYTOCHROME P450 46A1

(Homo sapiens) 		PF00067
(p450) 		7 PHE A  80
TYR A 109
VAL A 126
THR A 306
GLU A 472
ALA A 474
THR A 475
 None
None
HEM  A 505 ( 3.8A)
HEM  A 505 (-3.7A)
None
None
None
 0.86A 4fiaA-2q9gA:
65.8		 4fiaA-2q9gA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2q9g CYTOCHROME P450 46A1

(Homo sapiens) 		PF00067
(p450) 		9 TYR A 109
LEU A 112
PHE A 121
VAL A 126
ALA A 302
THR A 306
TRP A 368
ALA A 474
THR A 475
 None
None
None
HEM  A 505 ( 3.8A)
HEM  A 505 (-3.7A)
HEM  A 505 (-3.7A)
None
None
None
 0.67A 4fiaA-2q9gA:
65.8		 4fiaA-2q9gA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2q9g CYTOCHROME P450 46A1

(Homo sapiens) 		PF00067
(p450) 		7 TYR A 109
VAL A 126
THR A 306
TRP A 368
GLU A 472
ALA A 474
THR A 475
 None
HEM  A 505 ( 3.8A)
HEM  A 505 (-3.7A)
None
None
None
None
 0.77A 4fiaA-2q9gA:
65.8		 4fiaA-2q9gA:
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.
2rc3 CBS DOMAIN

(Nitrosomonas
europaea) 		PF00571
(CBS) 		5 LEU A 137
THR A  99
GLU A  75
ALA A  60
THR A  74
 NAD  A1000 (-3.9A)
BR  A 177 ( 4.2A)
None
NAD  A1000 (-4.0A)
BR  A 171 (-4.0A)
 1.22A 4fiaA-2rc3A:
undetectable		 4fiaA-2rc3A:
14.47
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.
2v9p REPLICATION PROTEIN
E1

(Deltapapillomavirus
4) 		PF00519
(PPV_E1_C) 		5 ARG A 486
ALA A 458
TRP A 485
ALA A 483
THR A 481
 None
 1.26A 4fiaA-2v9pA:
undetectable		 4fiaA-2v9pA:
21.85
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.
2vfv XYLITOL OXIDASE

(Streptomyces
coelicolor) 		PF01565
(FAD_binding_4)
PF04030
(ALO) 		5 PHE A 394
ALA A  52
TRP A 373
ALA A 117
THR A 118
 None
SFD  A1418 ( 4.3A)
None
SFD  A1418 (-3.2A)
SFD  A1418 (-2.8A)
 1.24A 4fiaA-2vfvA:
undetectable		 4fiaA-2vfvA:
23.53
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.
2vmx SERINE
HYDROXYMETHYLTRANSFE
RASE

(Geobacillus
stearothermophilus) 		PF00464
(SHMT) 		5 PHE A  82
ALA A 202
THR A 227
GLU A 272
ALA A 273
 None
 1.23A 4fiaA-2vmxA:
undetectable		 4fiaA-2vmxA:
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.
2xua 3-OXOADIPATE
ENOL-LACTONASE

(Paraburkholderia
xenovorans) 		PF12146
(Hydrolase_4) 		5 LEU A 228
VAL A 211
ALA A 235
GLU A 201
ALA A 202
 None
 1.22A 4fiaA-2xuaA:
undetectable		 4fiaA-2xuaA:
21.28
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.
2yn0 TRANSCRIPTION FACTOR
TAU 55 KDA SUBUNIT

(Saccharomyces
cerevisiae) 		PF00300
(His_Phos_1) 		5 LEU A  70
VAL A 118
ALA A  77
GLU A  87
ALA A  63
 None
 1.30A 4fiaA-2yn0A:
undetectable		 4fiaA-2yn0A:
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.
2ywb GMP SYNTHASE
[GLUTAMINE-HYDROLYZI
NG]

(Thermus
thermophilus) 		PF00117
(GATase)
PF00958
(GMP_synt_C) 		5 LEU A 466
VAL A 422
ALA A 425
THR A 410
GLU A 473
 None
 1.10A 4fiaA-2ywbA:
undetectable		 4fiaA-2ywbA:
23.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2zf5 GLYCEROL KINASE

(Thermococcus
kodakarensis) 		PF00370
(FGGY_N)
PF02782
(FGGY_C) 		5 ALA O 305
THR O 373
GLU O 321
ALA O 319
THR O 322
 None
 1.19A 4fiaA-2zf5O:
undetectable		 4fiaA-2zf5O:
21.12
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.
3b1r RIBOKINASE, PUTATIVE

(Burkholderia
thailandensis) 		PF00294
(PfkB) 		5 LEU A 217
VAL A 214
THR A 203
GLU A 195
ALA A 196
 None
None
None
MG  A 503 ( 3.9A)
None
 1.10A 4fiaA-3b1rA:
undetectable		 4fiaA-3b1rA:
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.
3bqy PUTATIVE TETR FAMILY
TRANSCRIPTIONAL
REGULATOR

(Streptomyces
coelicolor) 		PF00440
(TetR_N)
PF02909
(TetR_C) 		5 LEU A 101
VAL A 154
ALA A 112
GLU A  68
ALA A  67
 None
 1.01A 4fiaA-3bqyA:
undetectable		 4fiaA-3bqyA:
20.36
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.
3del ARGININE BINDING
PROTEIN

(Chlamydia
trachomatis) 		PF00497
(SBP_bac_3) 		5 LEU B  71
PHE B  36
ALA B  64
GLU B 239
ALA B 236
 None
 1.25A 4fiaA-3delB:
undetectable		 4fiaA-3delB:
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.
3eap RHO
GTPASE-ACTIVATING
PROTEIN 11A

(Homo sapiens) 		PF00620
(RhoGAP) 		5 LEU A  15
VAL A  23
ALA A 140
ALA A 155
THR A 156
 None
 1.10A 4fiaA-3eapA:
undetectable		 4fiaA-3eapA:
20.26
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.
3eap RHO
GTPASE-ACTIVATING
PROTEIN 11A

(Homo sapiens) 		PF00620
(RhoGAP) 		5 PHE A 244
LEU A  15
ALA A 140
ALA A 155
THR A 156
 None
 1.23A 4fiaA-3eapA:
undetectable		 4fiaA-3eapA:
20.26
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.
3ecd SERINE
HYDROXYMETHYLTRANSFE
RASE 2

(Burkholderia
pseudomallei) 		PF00464
(SHMT) 		5 PHE A  90
ALA A 210
THR A 235
GLU A 281
ALA A 282
 None
 1.17A 4fiaA-3ecdA:
undetectable		 4fiaA-3ecdA:
23.03
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.
3elu METHYLTRANSFERASE

(Wesselsbron
virus) 		PF00972
(Flavi_NS5)
PF01728
(FtsJ) 		5 LEU A 259
VAL A 257
ARG A 264
ALA A  59
ALA A  92
 None
 1.05A 4fiaA-3eluA:
undetectable		 4fiaA-3eluA:
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.
3ip3 OXIDOREDUCTASE,
PUTATIVE

(Thermotoga
maritima) 		PF01408
(GFO_IDH_MocA)
PF02894
(GFO_IDH_MocA_C) 		5 VAL A 301
ARG A 110
ALA A 124
GLU A 311
THR A 310
 None
 1.27A 4fiaA-3ip3A:
undetectable		 4fiaA-3ip3A:
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.
3j9e VP5

(Bluetongue
virus) 		PF00901
(Orbi_VP5) 		5 TYR D 194
VAL D 235
ARG D 183
ALA D 175
THR D 174
 None
 1.27A 4fiaA-3j9eD:
undetectable		 4fiaA-3j9eD:
22.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3jzd IRON-CONTAINING
ALCOHOL
DEHYDROGENASE

(Cupriavidus
pinatubonensis) 		PF00465
(Fe-ADH) 		5 LEU A  41
ALA A 108
THR A 111
ALA A  80
THR A  81
 None
 1.08A 4fiaA-3jzdA:
undetectable		 4fiaA-3jzdA:
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.
3l8j PROGRAMMED CELL
DEATH PROTEIN 10

(Homo sapiens) 		PF06840
(DUF1241) 		5 TYR A 181
LEU A 178
PHE A 174
VAL A 190
THR A 130
 None
 1.25A 4fiaA-3l8jA:
undetectable		 4fiaA-3l8jA:
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.
3lwt PHOSPHOINOSITIDE
PHOSPHATASE SAC1

(Saccharomyces
cerevisiae) 		PF02383
(Syja_N) 		5 LEU X 194
PHE X 415
VAL X 420
ALA X 239
ALA X 192
 None
 1.28A 4fiaA-3lwtX:
undetectable		 4fiaA-3lwtX:
21.76
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.
3obe SUGAR PHOSPHATE
ISOMERASE/EPIMERASE

(Parabacteroides
distasonis) 		PF01261
(AP_endonuc_2) 		5 PHE A  90
LEU A 122
ALA A 180
ALA A 144
THR A 145
 None
 1.14A 4fiaA-3obeA:
undetectable		 4fiaA-3obeA:
20.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3pgy SERINE
HYDROXYMETHYLTRANSFE
RASE

(Staphylococcus
aureus) 		PF00464
(SHMT) 		5 PHE A  82
ALA A 202
THR A 227
GLU A 272
ALA A 273
 None
 1.18A 4fiaA-3pgyA:
undetectable		 4fiaA-3pgyA:
23.75
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.
3pm0 CYTOCHROME P450 1B1

(Homo sapiens) 		PF00067
(p450) 		5 PHE A 268
PHE A 134
VAL A 235
ALA A 330
THR A 334
 BHF  A 800 ( 3.8A)
BHF  A 800 (-4.8A)
None
HEM  A 900 ( 3.4A)
HEM  A 900 ( 3.2A)
 1.28A 4fiaA-3pm0A:
34.3		 4fiaA-3pm0A:
25.33
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.
3rhy N(G),N(G)-DIMETHYLAR
GININE
DIMETHYLAMINOHYDROLA
SE

(Pseudomonas
aeruginosa) 		PF02274
(Amidinotransf) 		5 LEU A 252
VAL A  96
ALA A  75
GLU A 114
ALA A 115
 None
 1.05A 4fiaA-3rhyA:
undetectable		 4fiaA-3rhyA:
21.67
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.
3ssz MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME,
N-TERMINAL DOMAIN
PROTEIN

(Rhodobacteraceae
bacterium KLH11) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 TYR A 172
VAL A 171
ALA A 383
GLU A 187
ALA A 191
 None
 1.15A 4fiaA-3sszA:
undetectable		 4fiaA-3sszA:
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.
3stp GALACTONATE
DEHYDRATASE,
PUTATIVE

(Labrenzia
aggregata) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 TYR A 149
VAL A 148
ALA A 360
GLU A 164
ALA A 168
 None
 1.20A 4fiaA-3stpA:
undetectable		 4fiaA-3stpA:
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.
3t05 PYRUVATE KINASE

(Staphylococcus
aureus) 		PF00224
(PK)
PF00391
(PEP-utilizers)
PF02887
(PK_C) 		5 VAL A 416
ARG A 408
ALA A 385
THR A 379
GLU A 404
 None
None
None
PO4  A 586 (-3.4A)
None
 1.25A 4fiaA-3t05A:
undetectable		 4fiaA-3t05A:
20.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4a5a NUCLEOSIDE-TRIPHOSPH
ATASE 1

(Toxoplasma
gondii) 		PF01150
(GDA1_CD39) 		5 PHE A 611
LEU A 309
VAL A 302
ALA A 234
THR A 232
 None
 1.07A 4fiaA-4a5aA:
undetectable		 4fiaA-4a5aA:
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.
4ay7 METHYLCOBALAMIN:
COENZYME M
METHYLTRANSFERASE

(Methanosarcina
mazei) 		PF01208
(URO-D) 		5 TYR A 105
LEU A 158
ALA A  84
GLU A 184
ALA A 185
 None
 1.30A 4fiaA-4ay7A:
undetectable		 4fiaA-4ay7A:
23.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4b0z 26S PROTEASOME
REGULATORY SUBUNIT
RPN12

(Schizosaccharomyces
pombe) 		PF10075
(CSN8_PSD8_EIF3K) 		5 PHE A 124
LEU A  99
GLU A 116
ALA A 114
THR A 113
 None
 1.17A 4fiaA-4b0zA:
undetectable		 4fiaA-4b0zA:
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.
4b8j IMPORTIN SUBUNIT
ALPHA-1A

(Oryza sativa) 		PF00514
(Arm)
PF01749
(IBB)
PF16186
(Arm_3) 		5 LEU A 205
ALA A 243
TRP A 223
ALA A 221
THR A 222
 None
 1.13A 4fiaA-4b8jA:
undetectable		 4fiaA-4b8jA:
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.
4ewt PEPTIDASE,
M20/M25/M40 FAMILY

(Staphylococcus
aureus) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		5 PHE A 321
VAL A 174
ALA A 379
GLU A 316
ALA A 317
 None
 1.08A 4fiaA-4ewtA:
undetectable		 4fiaA-4ewtA:
21.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ewt PEPTIDASE,
M20/M25/M40 FAMILY

(Staphylococcus
aureus) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		5 PHE A 321
VAL A 174
ALA A 379
GLU A 316
THR A 313
 None
 1.26A 4fiaA-4ewtA:
undetectable		 4fiaA-4ewtA:
21.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ge0 UNCHARACTERIZED
PROTEIN C22E12.03C

(Schizosaccharomyces
pombe) 		PF01965
(DJ-1_PfpI) 		5 LEU A 137
VAL A 133
ALA A 112
ALA A 117
THR A 116
 None
 1.20A 4fiaA-4ge0A:
undetectable		 4fiaA-4ge0A:
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.
4guc PROTEIN BA_2500

(Bacillus
anthracis) 		PF16723
(DUF5065) 		5 LEU A  70
PHE A 152
VAL A  67
ALA A 138
THR A 125
 None
 1.19A 4fiaA-4gucA:
undetectable		 4fiaA-4gucA:
13.04
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.
4l1f ACYL-COA
DEHYDROGENASE DOMAIN
PROTEIN

(Acidaminococcus
fermentans) 		PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M)
PF02771
(Acyl-CoA_dh_N) 		5 LEU A 212
ALA A 122
GLU A 199
ALA A 210
THR A 209
 None
None
None
None
FAD  A 401 ( 3.9A)
 1.28A 4fiaA-4l1fA:
undetectable		 4fiaA-4l1fA:
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.
4muo UNCHARACTERIZED
PROTEIN YBIB

(Escherichia
coli) 		PF02885
(Glycos_trans_3N) 		5 VAL A 112
ALA A 102
THR A  98
GLU A 127
THR A 126
 None
 1.29A 4fiaA-4muoA:
undetectable		 4fiaA-4muoA:
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.
4mzy NICOTINATE
PHOSPHORIBOSYLTRANSF
ERASE

(Enterococcus
faecalis) 		PF04095
(NAPRTase) 		5 PHE A 258
VAL A 261
ALA A 245
GLU A 281
ALA A 282
 None
 1.17A 4fiaA-4mzyA:
undetectable		 4fiaA-4mzyA:
23.22
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.
4ng3 5-CARBOXYVANILLATE
DECARBOXYLASE

(Sphingomonas
paucimobilis) 		PF04909
(Amidohydro_2) 		5 LEU A  34
VAL A  38
ARG A 175
THR A  11
ALA A  77
 1DF  A 402 (-4.5A)
None
None
None
1DF  A 402 (-3.7A)
 1.28A 4fiaA-4ng3A:
undetectable		 4fiaA-4ng3A:
22.02
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.
4pev MEMBRANE LIPOPROTEIN
FAMILY PROTEIN

(Aeropyrum
pernix) 		PF02608
(Bmp) 		5 ALA A 280
THR A 252
GLU A 266
ALA A 265
THR A 264
 None
 1.16A 4fiaA-4pevA:
undetectable		 4fiaA-4pevA:
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.
4r33 NOSL

(Streptomyces
actuosus) 		PF06968
(BATS) 		5 LEU A  89
VAL A 137
ALA A 164
GLU A 123
THR A 122
 None
 1.23A 4fiaA-4r33A:
undetectable		 4fiaA-4r33A:
21.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4tvc DEXTRANSUCRASE

(Leuconostoc
mesenteroides) 		PF02324
(Glyco_hydro_70) 		5 PHE A2641
LEU A2166
PHE A2214
VAL A2711
GLU A2327
 None
None
None
IYR  A2712 ( 3.0A)
None
 1.19A 4fiaA-4tvcA:
undetectable		 4fiaA-4tvcA:
18.21
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.
4wjg HAPTOGLOBIN-HEMOGLOB
IN RECEPTOR

(Trypanosoma
brucei) 		no annotation 5 LEU E  97
VAL E 100
ALA E 278
GLU E 130
ALA E 128
 None
 1.02A 4fiaA-4wjgE:
undetectable		 4fiaA-4wjgE:
22.77
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.
4wxb SERINE
HYDROXYMETHYLTRANSFE
RASE

(Streptococcus
thermophilus) 		PF00464
(SHMT) 		5 PHE A  80
ALA A 200
THR A 225
GLU A 271
ALA A 272
 None
 1.18A 4fiaA-4wxbA:
undetectable		 4fiaA-4wxbA:
22.18
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.
4zhj MG-CHELATASE SUBUNIT
CHLH

(Synechocystis
sp. PCC 6803) 		PF02514
(CobN-Mg_chel)
PF11965
(DUF3479) 		5 LEU A 890
PHE A 891
ARG A 790
ALA A 838
ALA A 786
 None
 1.23A 4fiaA-4zhjA:
undetectable		 4fiaA-4zhjA:
17.28
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.
4zrx F5/8 TYPE C DOMAIN
PROTEIN

(Bacteroides
ovatus) 		PF00754
(F5_F8_type_C)
PF01120
(Alpha_L_fucos) 		5 TYR A 180
ALA A 222
THR A 226
GLU A 190
THR A 189
 None
 1.22A 4fiaA-4zrxA:
undetectable		 4fiaA-4zrxA:
21.84
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.
5a2g CARBOXYLIC ESTER
HYDROLASE

(Hungatella
hathewayi) 		PF00135
(COesterase) 		5 PHE A 386
PHE A 219
ALA A 215
ALA A 310
THR A 307
 None
 1.16A 4fiaA-5a2gA:
undetectable		 4fiaA-5a2gA:
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.
5ah4 DNA POLYMERASE III
SUBUNIT BETA

(Mycolicibacterium
smegmatis) 		PF00712
(DNA_pol3_beta)
PF02767
(DNA_pol3_beta_2)
PF02768
(DNA_pol3_beta_3) 		5 LEU A 363
PHE A 352
ARG A 183
THR A 279
THR A 339
 None
 1.26A 4fiaA-5ah4A:
undetectable		 4fiaA-5ah4A:
24.79
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.
5c1f SEPTATION PROTEIN
IMP2

(Schizosaccharomyces
pombe) 		PF00611
(FCH) 		5 LEU A 223
PHE A 222
VAL A 226
ALA A 104
GLU A  37
 None
 1.06A 4fiaA-5c1fA:
undetectable		 4fiaA-5c1fA:
21.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ddv 2-C-METHYL-D-ERYTHRI
TOL 4-PHOSPHATE
CYTIDYLYLTRANSFERASE

(Bacillus
subtilis) 		PF01128
(IspD) 		5 PHE A 164
VAL A 198
ALA A 187
GLU A 175
ALA A 172
 None
 1.20A 4fiaA-5ddvA:
undetectable		 4fiaA-5ddvA:
20.22
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.
5dp1 CURK

(Moorea
producens) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 PHE A 271
LEU A 224
VAL A 155
ALA A 172
ALA A 139
 None
 1.23A 4fiaA-5dp1A:
undetectable		 4fiaA-5dp1A:
22.78
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.
5dzz DESMOPLAKIN

(Homo sapiens) 		PF00681
(Plectin) 		5 PHE A2415
ALA A2294
THR A2298
ALA A2373
THR A2374
 None
 0.91A 4fiaA-5dzzA:
undetectable		 4fiaA-5dzzA:
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.
5efv PHI ETA ORF 56-LIKE
PROTEIN

(Staphylococcus
virus 11) 		no annotation 5 TYR A 392
LEU A 403
PHE A 167
VAL A 169
GLU A 151
 None
 1.30A 4fiaA-5efvA:
undetectable		 4fiaA-5efvA:
20.43
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.
5g1n CAD PROTEIN

(Homo sapiens) 		PF00185
(OTCace)
PF02729
(OTCace_N) 		5 LEU A2142
VAL A2078
ARG A2200
ALA A2135
ALA A2175
 None
 1.24A 4fiaA-5g1nA:
undetectable		 4fiaA-5g1nA:
20.43
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.
5h9x BETA-1,3-GLUCANASE

(Paenibacillus
barengoltzii) 		PF16483
(Glyco_hydro_64) 		5 PHE A  68
TYR A  31
VAL A  33
ALA A  62
ALA A   7
 None
 1.30A 4fiaA-5h9xA:
undetectable		 4fiaA-5h9xA:
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.
5hj7 GLUTAMATE RACEMASE

(Mycobacterium
tuberculosis) 		PF01177
(Asp_Glu_race) 		5 TYR A  35
VAL A  10
ARG A  22
THR A 212
ALA A  23
 None
 1.18A 4fiaA-5hj7A:
undetectable		 4fiaA-5hj7A:
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.
5hu6 HAPTOGLOBIN-HEMOGLOB
IN RECEPTOR

(Trypanosoma
brucei) 		no annotation 5 LEU D  97
VAL D 100
ALA D 278
GLU D 130
ALA D 128
 None
 1.24A 4fiaA-5hu6D:
undetectable		 4fiaA-5hu6D:
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.
5ko8 NITROREDUCTASE

(Haliscomenobacter
hydrossis) 		PF00881
(Nitroreductase) 		5 PHE A 118
LEU A 195
VAL A 127
GLU A  88
ALA A  87
 None
 1.24A 4fiaA-5ko8A:
undetectable		 4fiaA-5ko8A:
20.17
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.
5l8s AMINO ACYL PEPTIDASE

(Sporosarcina
psychrophila) 		PF00326
(Peptidase_S9) 		5 TYR A 275
LEU A 227
VAL A 240
THR A 213
THR A 209
 None
 1.28A 4fiaA-5l8sA:
undetectable		 4fiaA-5l8sA:
24.69
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.
5mnd GRANULIN

(Cydia pomonella
granulovirus) 		PF00738
(Polyhedrin) 		5 PHE A 197
VAL A 201
ARG A  99
ALA A 180
GLU A  96
 None
 1.25A 4fiaA-5mndA:
undetectable		 4fiaA-5mndA:
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.
5mwa BIFUNCTIONAL EPOXIDE
HYDROLASE 2

(Homo sapiens) 		no annotation 5 PHE A  86
LEU A  23
VAL A  19
THR A  50
ALA A  40
 None
None
8S9  A 302 (-3.8A)
8S9  A 302 ( 4.8A)
None
 1.29A 4fiaA-5mwaA:
undetectable		 4fiaA-5mwaA:
10.75
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.
5u2p SUGAR ABC
TRANSPORTER
SUBSTRATE-BINDING
PROTEIN

(Treponema
pallidum) 		PF01547
(SBP_bac_1) 		5 LEU A  84
VAL A  99
ARG A  87
ALA A 318
ALA A  93
 None
 1.21A 4fiaA-5u2pA:
undetectable		 4fiaA-5u2pA:
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.
5vmb SERINE
HYDROXYMETHYLTRANSFE
RASE

(Acinetobacter
baumannii) 		PF00464
(SHMT) 		5 PHE A  85
ALA A 205
THR A 230
GLU A 277
ALA A 278
 None
 1.17A 4fiaA-5vmbA:
undetectable		 4fiaA-5vmbA:
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.
5vyw PYRUVATE CARBOXYLASE

(Lactococcus
lactis) 		PF00289
(Biotin_carb_N)
PF00682
(HMGL-like)
PF02436
(PYC_OADA)
PF02785
(Biotin_carb_C)
PF02786
(CPSase_L_D2) 		5 LEU A 727
VAL A 725
ALA A 689
ALA A 697
THR A 695
 None
 0.99A 4fiaA-5vywA:
undetectable		 4fiaA-5vywA:
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.
5w81 CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR

(Danio rerio) 		PF00005
(ABC_tran)
PF00664
(ABC_membrane)
PF14396
(CFTR_R) 		5 LEU A 341
VAL A 323
GLU A 932
ALA A 929
THR A 930
 None
 1.16A 4fiaA-5w81A:
0.6		 4fiaA-5w81A:
15.18
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.
6a91 -

(-) 		no annotation 5 PHE A1501
VAL A1500
ARG A1131
THR A1426
GLU A1419
 None
 1.24A 4fiaA-6a91A:
undetectable		 4fiaA-6a91A:
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.
6c6l V-TYPE PROTON ATPASE
SUBUNIT D

(Saccharomyces
cerevisiae) 		no annotation 5 PHE B 288
TYR B 275
LEU B 269
VAL B 272
ALA B 252
 None
 1.21A 4fiaA-6c6lB:
undetectable		 4fiaA-6c6lB:
10.75
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.
6ejm SINGLE CHAIN FV
FRAGMENT

(Mus musculus) 		no annotation 5 LEU H 268
PHE H 277
ARG H 225
THR H  88
THR H 138
 None
 1.28A 4fiaA-6ejmH:
undetectable		 4fiaA-6ejmH:
12.38
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.
6fwf NITRIC-OXIDE
REDUCTASE

(Neisseria
meningitidis) 		no annotation 5 PHE A 455
ALA A 646
TRP A 430
ALA A 350
THR A 349
 None
 1.16A 4fiaA-6fwfA:
undetectable		 4fiaA-6fwfA:
10.09