SIMILAR PATTERNS OF AMINO ACIDS FOR 4FWD_A_BO2A801_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.
1a6d THERMOSOME (ALPHA
SUBUNIT)

(Thermoplasma
acidophilum) 		PF00118
(Cpn60_TCP1) 		5 VAL A 360
GLU A 349
VAL A 310
ILE A 218
SER A 370
 None
 1.12A 4fwdA-1a6dA:
undetectable		 4fwdA-1a6dA:
22.84
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.
1c7o CYSTALYSIN

(Treponema
denticola) 		PF00155
(Aminotran_1_2) 		5 VAL A 106
GLU A 134
ILE A 130
GLY A 115
ALA A 167
 None
 1.21A 4fwdA-1c7oA:
0.3		 4fwdA-1c7oA:
18.82
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.
1d6s O-ACETYLSERINE
SULFHYDRYLASE

(Salmonella
enterica) 		PF00291
(PALP) 		6 VAL A 247
VAL A 246
VAL A 170
ILE A 172
GLY A 174
ALA A 275
 None
 1.11A 4fwdA-1d6sA:
0.0		 4fwdA-1d6sA:
19.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1dcu FRUCTOSE-1,6-BISPHOS
PHATASE

(Pisum sativum) 		PF00316
(FBPase) 		5 VAL A 123
VAL A 124
ILE A  45
GLY A 188
ALA A 186
 None
 0.99A 4fwdA-1dcuA:
0.0		 4fwdA-1dcuA:
18.26
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.
1ewr DNA MISMATCH REPAIR
PROTEIN MUTS

(Thermus
aquaticus) 		PF00488
(MutS_V)
PF05188
(MutS_II)
PF05190
(MutS_IV)
PF05192
(MutS_III) 		5 VAL A 728
VAL A 579
ILE A 581
GLY A 583
ALA A 587
 None
 1.11A 4fwdA-1ewrA:
3.2		 4fwdA-1ewrA:
29.41
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.
1fh0 CATHEPSIN V

(Homo sapiens) 		PF00112
(Peptidase_C1) 		5 VAL A 115
VAL A 114
VAL A 129
ILE A 132
ALA A 212
 None
 1.18A 4fwdA-1fh0A:
0.2		 4fwdA-1fh0A:
14.79
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.
1jd1 HYPOTHETICAL 13.9
KDA PROTEIN IN
FCY2-PET117
INTERGENIC REGION

(Saccharomyces
cerevisiae) 		PF01042
(Ribonuc_L-PSP) 		5 VAL A  77
GLU A 120
VAL A  56
ILE A  60
ALA A 125
 None
 1.14A 4fwdA-1jd1A:
undetectable		 4fwdA-1jd1A:
9.45
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.
1nne DNA MISMATCH REPAIR
PROTEIN MUTS

(Thermus
aquaticus) 		PF00488
(MutS_V)
PF01624
(MutS_I)
PF05188
(MutS_II)
PF05190
(MutS_IV)
PF05192
(MutS_III) 		5 VAL A 728
VAL A 579
ILE A 581
GLY A 583
ALA A 587
 None
None
None
SO4  A 852 (-4.9A)
ADP  A 999 (-4.4A)
 1.12A 4fwdA-1nneA:
4.0		 4fwdA-1nneA:
28.37
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.
1qdn PROTEIN
(N-ETHYLMALEIMIDE
SENSITIVE FUSION
PROTEIN (NSF))

(Cricetulus
griseus) 		PF02359
(CDC48_N)
PF02933
(CDC48_2) 		5 VAL A  24
VAL A  23
VAL A  37
GLY A  32
SER A  31
 None
BME  A 400 (-4.3A)
None
None
None
 1.17A 4fwdA-1qdnA:
undetectable		 4fwdA-1qdnA:
13.41
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.
1qdn PROTEIN
(N-ETHYLMALEIMIDE
SENSITIVE FUSION
PROTEIN (NSF))

(Cricetulus
griseus) 		PF02359
(CDC48_N)
PF02933
(CDC48_2) 		5 VAL A  24
VAL A  23
VAL A  80
GLY A  32
SER A  31
 None
BME  A 400 (-4.3A)
None
None
None
 1.24A 4fwdA-1qdnA:
undetectable		 4fwdA-1qdnA:
13.41
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.
1spi FRUCTOSE
1,6-BISPHOSPHATASE

(Spinacia
oleracea) 		PF00316
(FBPase) 		5 VAL A 125
VAL A 126
ILE A  47
GLY A 189
ALA A 187
 None
 1.00A 4fwdA-1spiA:
undetectable		 4fwdA-1spiA:
20.11
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.
1td2 PYRIDOXAMINE KINASE

(Escherichia
coli) 		PF08543
(Phos_pyr_kin) 		5 VAL A 179
GLU A 170
ILE A 172
GLY A 175
SER A 140
 None
 1.21A 4fwdA-1td2A:
undetectable		 4fwdA-1td2A:
17.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1xhk PUTATIVE PROTEASE LA
HOMOLOG

(Methanocaldococcus
jannaschii) 		PF05362
(Lon_C) 		5 VAL A 467
GLY A 548
SER A 550
ALA A 551
LYS A 593
 None
 0.80A 4fwdA-1xhkA:
13.3		 4fwdA-1xhkA:
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.
1xp4 D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE

(Streptococcus
pneumoniae) 		PF00768
(Peptidase_S11)
PF07943
(PBP5_C) 		5 VAL A 264
VAL A 265
VAL A  52
ILE A  54
GLY A 241
 None
None
None
None
SO4  A 464 ( 3.8A)
 1.09A 4fwdA-1xp4A:
undetectable		 4fwdA-1xp4A:
20.14
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.
2b18 GTP-SENSING
TRANSCRIPTIONAL
PLEIOTROPIC
REPRESSOR CODY

(Bacillus
subtilis) 		PF06018
(CodY) 		5 VAL A 150
VAL A 149
VAL A 114
ILE A 116
GLY A 118
 None
 1.22A 4fwdA-2b18A:
undetectable		 4fwdA-2b18A:
12.79
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.
2cs5 TYROSINE-PROTEIN
PHOSPHATASE,
NON-RECEPTOR TYPE 4

(Homo sapiens) 		PF00595
(PDZ) 		5 VAL A  67
VAL A  68
VAL A  83
ILE A  70
GLY A  72
 None
 1.08A 4fwdA-2cs5A:
undetectable		 4fwdA-2cs5A:
11.15
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.
2dis UNNAMED PROTEIN
PRODUCT

(Homo sapiens) 		PF00076
(RRM_1) 		5 VAL A  32
GLU A  27
ILE A  29
GLY A  35
ALA A  68
 None
 1.16A 4fwdA-2disA:
undetectable		 4fwdA-2disA:
9.67
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.
2dyy UPF0076 PROTEIN
PH0854

(Pyrococcus
horikoshii) 		PF01042
(Ribonuc_L-PSP) 		5 VAL A  75
GLU A 118
VAL A  54
ILE A  58
ALA A 123
 None
 1.13A 4fwdA-2dyyA:
undetectable		 4fwdA-2dyyA:
10.61
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.
2gef PROTEASE VP4

(Blotched
snakehead virus) 		PF01768
(Birna_VP4) 		5 VAL A 591
VAL A 592
GLY A 690
SER A 692
LYS A 729
 None
 0.56A 4fwdA-2gefA:
10.9		 4fwdA-2gefA:
15.19
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.
2gp4 6-PHOSPHOGLUCONATE
DEHYDRATASE

(Shewanella
oneidensis) 		PF00920
(ILVD_EDD) 		5 VAL A 473
VAL A 472
VAL A 546
ILE A 544
GLY A 541
 None
 1.16A 4fwdA-2gp4A:
undetectable		 4fwdA-2gp4A:
24.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2iu3 BIFUNCTIONAL PURINE
BIOSYNTHESIS PROTEIN
PURH

(Gallus gallus) 		PF01808
(AICARFT_IMPCHas)
PF02142
(MGS) 		5 VAL A 100
VAL A  99
VAL A  73
ILE A  77
ALA A 137
 None
 1.22A 4fwdA-2iu3A:
undetectable		 4fwdA-2iu3A:
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.
2j1l RHO-RELATED
GTP-BINDING PROTEIN
RHOD

(Homo sapiens) 		PF00071
(Ras) 		5 VAL A  20
VAL A  21
VAL A 127
ILE A 125
ALA A 190
 None
 1.04A 4fwdA-2j1lA:
3.0		 4fwdA-2j1lA:
15.10
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.
2j1o GERANYLGERANYL
PYROPHOSPHATE
SYNTHETASE

(Sinapis alba) 		PF00348
(polyprenyl_synt) 		5 VAL A 146
VAL A 147
GLU A 152
ILE A 207
SER A 142
 None
 1.23A 4fwdA-2j1oA:
undetectable		 4fwdA-2j1oA:
17.21
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.
2lav VACCINIA-RELATED
KINASE 1

(Homo sapiens) 		PF00069
(Pkinase) 		5 VAL A  69
VAL A  70
ILE A  43
GLY A  40
ALA A  66
 None
 1.04A 4fwdA-2lavA:
undetectable		 4fwdA-2lavA:
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.
2ma4 PUTATIVE PERIPLASMIC
PROTEIN

(Salmonella
enterica) 		PF07338
(DUF1471) 		5 VAL A  70
VAL A  71
ILE A  43
GLY A  41
ALA A  67
 None
 0.94A 4fwdA-2ma4A:
undetectable		 4fwdA-2ma4A:
6.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2owl RECOMBINATION-ASSOCI
ATED PROTEIN RDGC

(Escherichia
coli) 		PF04381
(RdgC) 		5 VAL A 163
VAL A 164
VAL A 139
ILE A 137
GLY A 135
 None
 0.82A 4fwdA-2owlA:
undetectable		 4fwdA-2owlA:
18.42
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.
2p10 MLL9387 PROTEIN

(Mesorhizobium
japonicum) 		PF09370
(PEP_hydrolase) 		5 VAL A  96
VAL A  80
ILE A  53
GLY A  33
ALA A  40
 None
 1.08A 4fwdA-2p10A:
undetectable		 4fwdA-2p10A:
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.
2pnm PROTEASE VP4

(Infectious
pancreatic
necrosis virus) 		PF01768
(Birna_VP4) 		5 VAL A 545
VAL A 546
GLY A 631
SER A 633
ALA A 634
 None
 0.50A 4fwdA-2pnmA:
7.0		 4fwdA-2pnmA:
15.13
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.
2psy KALLIKREIN-5

(Homo sapiens) 		PF00089
(Trypsin) 		5 VAL A 199
VAL A 200
VAL A 162
ILE A 160
SER A 139
 None
 1.15A 4fwdA-2psyA:
undetectable		 4fwdA-2psyA:
13.98
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.
2q7n LEUKEMIA INHIBITORY
FACTOR RECEPTOR

(Mus musculus) 		PF00041
(fn3) 		5 VAL A 279
VAL A 278
ILE A 253
SER A 259
ALA A 281
 None
 1.18A 4fwdA-2q7nA:
undetectable		 4fwdA-2q7nA:
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.
2uvk YJHT

(Escherichia
coli) 		PF01344
(Kelch_1) 		5 VAL A  22
ILE A  24
GLY A  13
SER A  28
ALA A  29
 None
 1.10A 4fwdA-2uvkA:
undetectable		 4fwdA-2uvkA:
18.72
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.
2vns METALLOREDUCTASE
STEAP3

(Homo sapiens) 		PF03807
(F420_oxidored) 		5 VAL A 112
VAL A 165
ILE A 167
GLY A 169
ALA A 174
 None
 1.03A 4fwdA-2vnsA:
undetectable		 4fwdA-2vnsA:
15.41
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.
2woz KELCH REPEAT AND BTB
DOMAIN-CONTAINING
PROTEIN 10

(Rattus
norvegicus) 		PF01344
(Kelch_1) 		5 VAL A 512
ILE A 535
GLY A 502
SER A 509
ALA A 510
 None
 1.10A 4fwdA-2wozA:
undetectable		 4fwdA-2wozA:
18.48
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.
2x98 ALKALINE PHOSPHATASE

(Halobacterium
salinarum) 		PF00245
(Alk_phosphatase) 		5 VAL A 136
GLU A 181
ILE A 133
SER A 124
ALA A 123
 None
 1.09A 4fwdA-2x98A:
undetectable		 4fwdA-2x98A:
21.87
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.
2xzo REGULATOR OF
NONSENSE TRANSCRIPTS
1

(Homo sapiens) 		PF04851
(ResIII)
PF13086
(AAA_11)
PF13087
(AAA_12) 		5 VAL A 527
GLU A 637
VAL A 660
ILE A 635
ALA A 620
 None
ALF  A1005 (-3.0A)
None
None
None
 1.12A 4fwdA-2xzoA:
undetectable		 4fwdA-2xzoA:
22.10
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.
2z2i PEPTIDYL-TRNA
HYDROLASE

(Mycobacterium
tuberculosis) 		PF01195
(Pept_tRNA_hydro) 		5 VAL A   8
VAL A  92
VAL A  85
GLY A  73
SER A  72
 None
 1.24A 4fwdA-2z2iA:
undetectable		 4fwdA-2z2iA:
13.93
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.
2zi8 PROBABLE
BIPHENYL-2,3-DIOL
1,2-DIOXYGENASE BPHC

(Mycobacterium
tuberculosis) 		PF00903
(Glyoxalase) 		5 VAL A  52
VAL A  53
GLU A  12
GLY A  38
ALA A  35
 None
 1.18A 4fwdA-2zi8A:
undetectable		 4fwdA-2zi8A:
18.02
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.
3bb7 INTERPAIN A

(Prevotella
intermedia) 		PF01640
(Peptidase_C10)
PF13734
(Inhibitor_I69) 		5 VAL A 308
GLU A 282
VAL A 355
ILE A 290
ALA A 306
 None
 1.25A 4fwdA-3bb7A:
undetectable		 4fwdA-3bb7A:
18.42
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.
3cji POLYPROTEIN

(Senecavirus A) 		no annotation 5 VAL A 127
VAL A 128
GLU A 131
VAL A  48
ILE A  46
 None
 1.02A 4fwdA-3cjiA:
undetectable		 4fwdA-3cjiA:
16.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3dlt ESTERASE D

(Lactobacillus
rhamnosus) 		PF12146
(Hydrolase_4) 		5 VAL A  19
VAL A  18
ILE A 110
GLY A 113
ALA A 100
 None
 1.17A 4fwdA-3dltA:
undetectable		 4fwdA-3dltA:
16.71
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.
3f0i ARSENATE REDUCTASE

(Vibrio cholerae) 		PF03960
(ArsC) 		5 VAL A   3
VAL A   4
VAL A 112
ILE A 115
GLY A 101
 None
 1.11A 4fwdA-3f0iA:
undetectable		 4fwdA-3f0iA:
10.57
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.
3fg2 PUTATIVE RUBREDOXIN
REDUCTASE

(Rhodopseudomonas
palustris) 		PF07992
(Pyr_redox_2)
PF14759
(Reductase_C) 		5 VAL P 147
VAL P 146
GLU P 167
ILE P 199
ALA P 150
 None
 1.12A 4fwdA-3fg2P:
undetectable		 4fwdA-3fg2P:
21.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3gjy SPERMIDINE SYNTHASE

(Corynebacterium
glutamicum) 		no annotation 5 VAL A  50
GLU A  32
VAL A  30
ILE A  47
ALA A 166
 None
 1.14A 4fwdA-3gjyA:
undetectable		 4fwdA-3gjyA:
18.22
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.
3h8f CYTOSOL
AMINOPEPTIDASE

(Pseudomonas
putida) 		PF00883
(Peptidase_M17)
PF02789
(Peptidase_M17_N) 		5 VAL A  73
GLU A  71
GLY A  67
SER A  39
ALA A  38
 None
 1.16A 4fwdA-3h8fA:
2.0		 4fwdA-3h8fA:
23.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3jsk CYPBP37 PROTEIN

(Neurospora
crassa) 		PF01946
(Thi4) 		5 GLU A 291
VAL A 242
ILE A 244
GLY A 299
SER A 322
 None
 1.17A 4fwdA-3jskA:
undetectable		 4fwdA-3jskA:
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.
3knb OBSCURIN-LIKE
PROTEIN 1

(Homo sapiens) 		PF07679
(I-set) 		5 VAL B  45
VAL B  44
GLU B  94
GLY B  39
ALA B  67
 None
 1.18A 4fwdA-3knbB:
undetectable		 4fwdA-3knbB:
11.85
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.
3kws PUTATIVE SUGAR
ISOMERASE

(Parabacteroides
distasonis) 		PF01261
(AP_endonuc_2) 		5 VAL A 146
GLU A 133
ILE A 135
GLY A 139
SER A 143
 None
 1.11A 4fwdA-3kwsA:
undetectable		 4fwdA-3kwsA:
17.60
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.
3ll5 GAMMA-GLUTAMYL
KINASE RELATED
PROTEIN

(Thermoplasma
acidophilum) 		PF00696
(AA_kinase) 		5 VAL A  31
VAL A  41
ILE A   6
GLY A 225
ALA A  24
 None
 1.04A 4fwdA-3ll5A:
undetectable		 4fwdA-3ll5A:
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.
3lpd ACIDIC EXTRACELLULAR
SUBTILISIN-LIKE
PROTEASE APRV2

(Dichelobacter
nodosus) 		PF00082
(Peptidase_S8) 		5 VAL A 132
VAL A 133
VAL A 109
ILE A 113
ALA A 130
 None
 1.23A 4fwdA-3lpdA:
undetectable		 4fwdA-3lpdA:
18.95
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.
3lyc PUTATIVE PECTINASE

(Parabacteroides
distasonis) 		PF10988
(DUF2807) 		5 VAL A  53
VAL A  52
ILE A  87
GLY A  48
ALA A 118
 None
 1.24A 4fwdA-3lycA:
undetectable		 4fwdA-3lycA:
16.53
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.
3qvm OLEI00960

(Oleispira
antarctica) 		PF00561
(Abhydrolase_1) 		5 VAL A  87
VAL A  99
ILE A 101
GLY A 103
SER A 107
 None
 1.24A 4fwdA-3qvmA:
undetectable		 4fwdA-3qvmA:
18.86
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.
3r9w GTPASE ERA

(Aquifex
aeolicus) 		PF01926
(MMR_HSR1)
PF07650
(KH_2) 		5 VAL A 121
VAL A 120
VAL A   6
ILE A   8
GLY A  10
 None
 0.80A 4fwdA-3r9wA:
undetectable		 4fwdA-3r9wA:
17.63
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.
3swd UDP-N-ACETYLGLUCOSAM
INE
1-CARBOXYVINYLTRANSF
ERASE

(Escherichia
coli) 		PF00275
(EPSP_synthase) 		5 VAL A 214
VAL A 157
ILE A 156
GLY A 153
ALA A 173
 None
 1.20A 4fwdA-3swdA:
undetectable		 4fwdA-3swdA:
22.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3vtf UDP-GLUCOSE
6-DEHYDROGENASE

(Pyrobaculum
islandicum) 		PF00984
(UDPG_MGDP_dh)
PF03720
(UDPG_MGDP_dh_C)
PF03721
(UDPG_MGDP_dh_N) 		5 VAL A 121
VAL A 122
GLU A 155
GLY A 175
ALA A 181
 None
None
UPG  A1001 (-3.7A)
None
None
 1.14A 4fwdA-3vtfA:
undetectable		 4fwdA-3vtfA:
22.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3w5v FERREDOXIN

(Zea mays) 		PF00175
(NAD_binding_1)
PF00970
(FAD_binding_6) 		5 VAL A  78
VAL A  92
VAL A  39
ILE A 147
GLY A 149
 None
 1.22A 4fwdA-3w5vA:
undetectable		 4fwdA-3w5vA:
16.60
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.
4b43 TRANSLATION
INITIATION FACTOR
IF-2

(Thermus
thermophilus) 		PF00009
(GTP_EFTU)
PF04760
(IF2_N) 		5 VAL A 122
VAL A 123
VAL A 148
ILE A 146
ALA A 234
 None
 1.19A 4fwdA-4b43A:
2.9		 4fwdA-4b43A:
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.
4bc7 ALKYLDIHYDROXYACETON
EPHOSPHATE SYNTHASE,
PEROXISOMAL

(Cavia porcellus) 		PF01565
(FAD_binding_4)
PF02913
(FAD-oxidase_C) 		5 VAL A 373
VAL A 338
GLU A 376
GLY A 311
SER A 315
 FAD  A 999 (-3.8A)
None
None
FAD  A 999 (-3.4A)
FAD  A 999 (-3.1A)
 1.08A 4fwdA-4bc7A:
undetectable		 4fwdA-4bc7A:
22.21
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.
4bi5 TRIOSEPHOSPHATE
ISOMERASE

(Giardia
intestinalis) 		PF00121
(TIM) 		5 VAL A  40
VAL A  39
VAL A 166
ILE A 125
ALA A  42
 None
 1.13A 4fwdA-4bi5A:
undetectable		 4fwdA-4bi5A:
17.21
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.
4c7o SIGNAL RECOGNITION
PARTICLE PROTEIN

(Escherichia
coli) 		PF00448
(SRP54)
PF02881
(SRP54_N) 		5 VAL A 246
VAL A 245
VAL A 103
GLY A 107
ALA A 111
 None
None
None
None
GDP  A1003 (-4.1A)
 0.98A 4fwdA-4c7oA:
1.9		 4fwdA-4c7oA:
18.26
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.
4c84 E3 UBIQUITIN-PROTEIN
LIGASE ZNRF3

(Danio rerio) 		no annotation 5 VAL A 153
VAL A 154
VAL A 112
GLY A  96
ALA A 124
 None
 1.09A 4fwdA-4c84A:
undetectable		 4fwdA-4c84A:
14.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4dg5 PHOSPHOGLYCERATE
KINASE

(Staphylococcus
aureus) 		PF00162
(PGK) 		5 VAL A 336
GLU A 308
VAL A 195
ILE A 197
GLY A 223
 None
 1.18A 4fwdA-4dg5A:
undetectable		 4fwdA-4dg5A:
19.02
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.
4eog PUTATIVE
UNCHARACTERIZED
PROTEIN

(Pyrococcus
furiosus) 		PF09455
(Cas_DxTHG) 		5 VAL A 430
VAL A 429
ILE A 434
GLY A 438
ALA A 469
 None
 1.14A 4fwdA-4eogA:
undetectable		 4fwdA-4eogA:
21.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ex6 ALNB

(Streptomyces
sp. CM020) 		PF13419
(HAD_2) 		5 VAL A 190
VAL A 172
VAL A 212
GLY A 176
ALA A 206
 None
 1.24A 4fwdA-4ex6A:
2.7		 4fwdA-4ex6A:
17.46
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4fwg TTC1975 PEPTIDASE

(Meiothermus
taiwanensis) 		PF05362
(Lon_C)
PF13654
(AAA_32) 		8 VAL A 503
VAL A 504
VAL A 576
ILE A 578
GLY A 580
SER A 582
ALA A 583
LYS A 625
 SLA  A 801 (-3.8A)
SLA  A 801 (-4.2A)
None
SLA  A 801 ( 4.7A)
SLA  A 801 (-3.1A)
SLA  A 801 (-1.3A)
SLA  A 801 ( 4.2A)
SLA  A 801 (-2.9A)
 0.45A 4fwdA-4fwgA:
55.0		 4fwdA-4fwgA:
99.32
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.
4grd PHOSPHORIBOSYLAMINOI
MIDAZOLE CARBOXYLASE
CATALYTIC SUBUNIT

(Burkholderia
cenocepacia) 		PF00731
(AIRC) 		5 VAL A 107
VAL A 114
GLY A  77
SER A 101
ALA A 100
 None
 1.25A 4fwdA-4grdA:
2.1		 4fwdA-4grdA:
13.68
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.
4h1s 5'-NUCLEOTIDASE

(Homo sapiens) 		PF00149
(Metallophos)
PF02872
(5_nucleotid_C) 		5 VAL A 240
VAL A 239
VAL A 171
ILE A 173
ALA A 114
 None
 1.18A 4fwdA-4h1sA:
undetectable		 4fwdA-4h1sA:
21.79
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.
4h1s 5'-NUCLEOTIDASE

(Homo sapiens) 		PF00149
(Metallophos)
PF02872
(5_nucleotid_C) 		5 VAL A 240
VAL A 239
VAL A 171
ILE A 173
GLY A 175
 None
 1.00A 4fwdA-4h1sA:
undetectable		 4fwdA-4h1sA:
21.79
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.
4jig DEHYDROGENASE

(Burkholderia
cenocepacia) 		PF13561
(adh_short_C2) 		5 VAL A  34
VAL A  10
VAL A  62
ILE A  36
GLY A  20
 None
 1.24A 4fwdA-4jigA:
2.4		 4fwdA-4jigA:
17.45
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.
4jo0 CMLA

(Streptomyces
venezuelae) 		PF12706
(Lactamase_B_2) 		5 VAL A 369
VAL A 370
GLU A 360
VAL A 354
GLY A 388
 None
 1.18A 4fwdA-4jo0A:
undetectable		 4fwdA-4jo0A:
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.
4ler PUTATIVE OUTER
MEMBRANE PROTEIN,
PROBABLY INVOLVED IN
NUTRIENT BINDING

(Bacteroides
vulgatus) 		PF12771
(SusD-like_2) 		5 VAL A  93
GLU A  99
GLY A  45
SER A  49
ALA A  50
 None
 1.18A 4fwdA-4lerA:
undetectable		 4fwdA-4lerA:
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.
4ler PUTATIVE OUTER
MEMBRANE PROTEIN,
PROBABLY INVOLVED IN
NUTRIENT BINDING

(Bacteroides
vulgatus) 		PF12771
(SusD-like_2) 		5 VAL A 311
GLU A  71
ILE A  66
GLY A 257
ALA A 315
 None
 1.12A 4fwdA-4lerA:
undetectable		 4fwdA-4lerA:
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.
4moz FRUCTOSE-BISPHOSPHAT
E ALDOLASE

(Slackia
heliotrinireducens) 		PF01791
(DeoC) 		5 VAL A 139
VAL A 138
VAL A 174
ILE A 172
GLY A 170
 None
 1.11A 4fwdA-4mozA:
undetectable		 4fwdA-4mozA:
21.01
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.
4nbq POLYRIBONUCLEOTIDE
NUCLEOTIDYLTRANSFERA
SE

(Coxiella
burnetii) 		PF00013
(KH_1)
PF00575
(S1)
PF01138
(RNase_PH)
PF03725
(RNase_PH_C)
PF03726
(PNPase) 		5 GLU A 377
VAL A 427
ILE A 428
SER A 449
ALA A 452
 None
 1.21A 4fwdA-4nbqA:
2.9		 4fwdA-4nbqA:
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.
4oq1 CELL WALL SURFACE
ANCHOR FAMILY
PROTEIN

(Streptococcus
pneumoniae) 		no annotation 5 VAL A 352
VAL A 351
VAL A 260
GLY A 306
ALA A 276
 None
 1.26A 4fwdA-4oq1A:
undetectable		 4fwdA-4oq1A:
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.
4p7y METHIONINE
GAMMA-LYASE

(Citrobacter
freundii) 		PF01053
(Cys_Met_Meta_PP) 		5 VAL A 184
VAL A 183
VAL A 166
ILE A 168
GLY A 200
 None
 1.13A 4fwdA-4p7yA:
undetectable		 4fwdA-4p7yA:
22.42
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.
4q9b NOVEL ANTIGEN
RECEPTOR

(Ginglymostoma
cirratum) 		PF07654
(C1-set) 		5 VAL A 277
VAL A 278
VAL A 247
ILE A 245
ALA A 275
 None
 1.20A 4fwdA-4q9bA:
undetectable		 4fwdA-4q9bA:
9.71
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.
4rho UNCHARACTERIZED
PROTEIN

(Burkholderia
pseudomallei) 		PF15579
(Imm52) 		5 VAL A 148
VAL A 147
VAL A 191
ILE A 201
ALA A 150
 None
 0.96A 4fwdA-4rhoA:
undetectable		 4fwdA-4rhoA:
16.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4xii CHOLINESTERASE

(Homo sapiens) 		PF00135
(COesterase) 		5 VAL A  97
VAL A 142
VAL A  25
ILE A  99
GLY A 187
 None
 1.17A 4fwdA-4xiiA:
undetectable		 4fwdA-4xiiA:
21.53
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.
4ylc HEAT SHOCK PROTEIN
HSP20

(Sulfolobus
solfataricus) 		PF00011
(HSP20) 		5 VAL A  39
GLU A  32
VAL A  94
ILE A 113
ALA A 102
 None
 1.22A 4fwdA-4ylcA:
undetectable		 4fwdA-4ylcA:
9.43
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.
4ynu GLUCOSE OXIDASE,
PUTATIVE

(Aspergillus
flavus) 		PF00732
(GMC_oxred_N)
PF05199
(GMC_oxred_C) 		5 VAL A 533
ILE A 272
GLY A  17
SER A  16
ALA A 557
 None
None
None
FAD  A 601 (-2.8A)
None
 1.20A 4fwdA-4ynuA:
undetectable		 4fwdA-4ynuA:
23.39
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.
4ypj BETA GALACTOSIDASE

(Bacillus
circulans) 		PF00703
(Glyco_hydro_2)
PF02836
(Glyco_hydro_2_C)
PF02837
(Glyco_hydro_2_N)
PF16355
(DUF4982) 		5 VAL A 748
VAL A 747
ILE A 826
GLY A 824
ALA A 750
 None
 0.96A 4fwdA-4ypjA:
undetectable		 4fwdA-4ypjA:
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.
5a8r METHYL-COENZYME M
REDUCTASE II SUBUNIT
GAMMA

(Methanothermobacter
marburgensis) 		PF02241
(MCR_beta)
PF02783
(MCR_beta_N) 		5 VAL B  42
VAL B  39
VAL B 200
ILE B 195
GLY B 191
 None
 1.25A 4fwdA-5a8rB:
undetectable		 4fwdA-5a8rB:
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.
5d2j 4-OXALOCROTONATE
DECARBOXYLASE NAHK

(Pseudomonas
putida) 		no annotation 5 VAL A 251
VAL A 188
GLU A 197
ILE A 249
GLY A 193
 None
 1.18A 4fwdA-5d2jA:
undetectable		 4fwdA-5d2jA:
17.66
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.
5dm6 50S RIBOSOMAL
PROTEIN L13

(Deinococcus
radiodurans) 		PF00572
(Ribosomal_L13) 		5 VAL G  82
VAL G  81
VAL G 131
ILE G 127
ALA G 152
 None
 1.23A 4fwdA-5dm6G:
undetectable		 4fwdA-5dm6G:
11.03
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.
5ees 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
REDUCTASE

(Corynebacterium
glutamicum) 		PF01113
(DapB_N)
PF05173
(DapB_C) 		5 VAL A  52
VAL A  51
VAL A  22
ILE A  18
GLY A   9
 None
None
None
None
NAP  A 302 (-3.5A)
 1.16A 4fwdA-5eesA:
undetectable		 4fwdA-5eesA:
17.37
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.
5ilg PHOTORECEPTOR
DEHYDROGENASE,
ISOFORM C

(Drosophila
melanogaster) 		PF00106
(adh_short) 		5 VAL A   9
VAL A  70
ILE A  36
GLY A  13
SER A  22
 None
 1.19A 4fwdA-5ilgA:
2.4		 4fwdA-5ilgA:
17.90
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.
5ilg PHOTORECEPTOR
DEHYDROGENASE,
ISOFORM C

(Drosophila
melanogaster) 		PF00106
(adh_short) 		5 VAL A  88
VAL A  70
ILE A  36
GLY A  13
SER A  22
 None
 1.25A 4fwdA-5ilgA:
2.4		 4fwdA-5ilgA:
17.90
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.
5j9s PROTEIN ENL

(Homo sapiens) 		PF03366
(YEATS) 		5 VAL A   9
GLU A 120
VAL A  98
GLY A  38
ALA A 138
 None
 1.08A 4fwdA-5j9sA:
undetectable		 4fwdA-5j9sA:
11.28
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.
5jvh 50S RIBOSOMAL
PROTEIN L13

(Deinococcus
radiodurans) 		PF00572
(Ribosomal_L13) 		5 VAL G  82
VAL G  81
VAL G 131
ILE G 127
ALA G 152
 None
 1.25A 4fwdA-5jvhG:
2.3		 4fwdA-5jvhG:
13.32
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.
5kj8 SYNAPTOTAGMIN-1

(Rattus
norvegicus) 		PF00168
(C2) 		5 VAL E 359
VAL E 358
GLU E 386
ILE E 276
GLY E 374
 None
 1.13A 4fwdA-5kj8E:
undetectable		 4fwdA-5kj8E:
16.58
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.
5lk4 MSCARLET

(Discosoma sp.) 		PF01353
(GFP) 		5 VAL A 212
VAL A 211
ILE A  30
GLY A  32
ALA A  45
 None
None
None
None
NRQ  A  67 ( 3.3A)
 1.12A 4fwdA-5lk4A:
undetectable		 4fwdA-5lk4A:
16.15
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.
5loe GTP-SENSING
TRANSCRIPTIONAL
PLEIOTROPIC
REPRESSOR CODY

(Bacillus
subtilis) 		PF06018
(CodY)
PF08222
(HTH_CodY) 		5 VAL A 150
VAL A 149
VAL A 114
ILE A 116
GLY A 118
 None
 1.22A 4fwdA-5loeA:
undetectable		 4fwdA-5loeA:
17.21
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.
5m0o TERMINAL
OLEFIN-FORMING FATTY
ACID DECARBOXYLASE

(Jeotgalicoccus
sp. ATCC 8456) 		PF00067
(p450) 		5 VAL A  49
VAL A  48
VAL A 308
ILE A 310
GLY A 315
 None
 1.09A 4fwdA-5m0oA:
undetectable		 4fwdA-5m0oA:
20.41
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.
5nd1 CAPSID PROTEIN

(Rosellinia
necatrix
quadrivirus 1) 		no annotation 5 VAL A 703
VAL A 283
ILE A 285
GLY A 287
ALA A 293
 None
 1.08A 4fwdA-5nd1A:
undetectable		 4fwdA-5nd1A:
8.09
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.
5un0 PROTEASOME ASSEMBLY
CHAPERONE 2 (PAC2)
HOMOLOGUE RV2125

(Mycobacterium
tuberculosis) 		PF09754
(PAC2) 		5 VAL 1  18
VAL 1  17
VAL 1 117
ILE 1 118
ALA 1 185
 None
 1.16A 4fwdA-5un01:
undetectable		 4fwdA-5un01:
16.71
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.
5uu1 SERINE/THREONINE-PRO
TEIN KINASE VRK2

(Homo sapiens) 		PF00069
(Pkinase) 		5 VAL A  59
VAL A  60
ILE A  35
GLY A  32
ALA A  56
 7DZ  A 401 (-4.6A)
None
7DZ  A 401 ( 4.9A)
None
None
 0.94A 4fwdA-5uu1A:
undetectable		 4fwdA-5uu1A:
17.83
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.
5w8o HOMOSERINE
O-ACETYLTRANSFERASE

(Mycolicibacterium
hassiacum) 		PF00561
(Abhydrolase_1) 		5 VAL A  54
VAL A  55
VAL A  83
GLY A 177
ALA A 371
 None
 1.17A 4fwdA-5w8oA:
undetectable		 4fwdA-5w8oA:
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.
6c2j RNAP2

(Escherichia
virus N4) 		no annotation 5 VAL B 100
VAL B 396
GLU B 394
GLY B  89
ALA B  93
 None
 1.07A 4fwdA-6c2jB:
undetectable		 4fwdA-6c2jB:
8.59
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.
6c6l V-TYPE PROTON ATPASE
SUBUNIT C''

(Saccharomyces
cerevisiae) 		no annotation 5 VAL C 201
VAL C 120
ILE C 117
GLY C 153
SER C 155
 None
 1.22A 4fwdA-6c6lC:
undetectable		 4fwdA-6c6lC:
9.41
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.
6esl BACTERIAL LEUCYL
AMINOPEPTIDASE

(Legionella
pneumophila) 		no annotation 5 VAL A 106
GLU A 112
ILE A 222
SER A 377
ALA A 376
 None
 1.16A 4fwdA-6eslA:
undetectable		 4fwdA-6eslA:
6.23