SIMILAR PATTERNS OF AMINO ACIDS FOR 2V32_B_BEZB1220_0

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.
1b7g PROTEIN
(GLYCERALDEHYDE
3-PHOSPHATE
DEHYDROGENASE)

(Sulfolobus
solfataricus) 		PF01113
(DapB_N)
PF02800
(Gp_dh_C) 		4 THR O 328
SER O 324
GLU O 307
ALA O 121
 None
 0.97A 2v32A-1b7gO:
undetectable
2v32B-1b7gO:
undetectable		 2v32A-1b7gO:
21.36
2v32B-1b7gO:
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.
1flg PROTEIN
(QUINOPROTEIN
ETHANOL
DEHYDROGENASE)

(Pseudomonas
aeruginosa) 		PF01011
(PQQ)
PF13360
(PQQ_2) 		4 PRO A 381
THR A 310
PRO A 311
ARG A 388
 None
 0.97A 2v32A-1flgA:
undetectable
2v32B-1flgA:
undetectable		 2v32A-1flgA:
16.18
2v32B-1flgA:
16.18
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.
1gy8 UDP-GALACTOSE
4-EPIMERASE

(Trypanosoma
brucei) 		PF01370
(Epimerase) 		4 PRO A 111
VAL A 108
SER A 107
GLU A 175
 None
 1.01A 2v32A-1gy8A:
undetectable
2v32B-1gy8A:
undetectable		 2v32A-1gy8A:
20.65
2v32B-1gy8A:
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.
1iyl MYRISTOYL-COA:PROTEI
N
N-MYRISTOYLTRANSFERA
SE

(Candida
albicans) 		PF01233
(NMT)
PF02799
(NMT_C) 		4 PRO A 130
THR A 156
PRO A 157
VAL A 158
 None
 0.90A 2v32A-1iylA:
undetectable
2v32B-1iylA:
undetectable		 2v32A-1iylA:
20.00
2v32B-1iylA:
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.
1mb9 BETA-LACTAM
SYNTHETASE

(Streptomyces
clavuligerus) 		PF00733
(Asn_synthase)
PF13537
(GATase_7) 		4 PRO A 385
VAL A 141
SER A 140
GLU A  78
 None
 0.98A 2v32A-1mb9A:
undetectable
2v32B-1mb9A:
undetectable		 2v32A-1mb9A:
19.84
2v32B-1mb9A:
19.84
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.
1n9b BETA-LACTAMASE SHV-2

(Klebsiella
pneumoniae) 		PF13354
(Beta-lactamase2) 		4 PRO A 107
SER A 109
GLU A 166
ALA A 135
 None
 0.80A 2v32A-1n9bA:
undetectable
2v32B-1n9bA:
undetectable		 2v32A-1n9bA:
23.24
2v32B-1n9bA:
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.
1nd7 WW DOMAIN-CONTAINING
PROTEIN 1

(Homo sapiens) 		PF00632
(HECT) 		4 THR A 575
VAL A 571
SER A 572
ARG A 601
 None
 0.94A 2v32A-1nd7A:
undetectable
2v32B-1nd7A:
undetectable		 2v32A-1nd7A:
20.26
2v32B-1nd7A:
20.26
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1prx HORF6

(Homo sapiens) 		PF00578
(AhpC-TSA)
PF10417
(1-cysPrx_C) 		4 THR A  44
PRO A  45
VAL A  46
ALA A 151
 CSO  A  47 ( 3.6A)
None
CSO  A  47 ( 3.1A)
CSO  A  47 ( 4.1A)
 0.84A 2v32A-1prxA:
27.2
2v32B-1prxA:
27.3		 2v32A-1prxA:
62.95
2v32B-1prxA:
62.95
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.
1rw9 CHONDROITIN AC LYASE

(Paenarthrobacter
aurescens) 		PF02278
(Lyase_8)
PF02884
(Lyase_8_C)
PF08124
(Lyase_8_N) 		4 PRO A 684
THR A 704
PRO A 703
GLU A 473
 None
 0.92A 2v32A-1rw9A:
undetectable
2v32B-1rw9A:
undetectable		 2v32A-1rw9A:
14.97
2v32B-1rw9A:
14.97
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.
1sqj OLIGOXYLOGLUCAN
REDUCING-END-SPECIFI
C CELLOBIOHYDROLASE

(Geotrichum sp.
M128) 		PF15899
(BNR_6) 		4 THR A 365
PRO A 366
VAL A 367
ALA A  10
 None
 0.87A 2v32A-1sqjA:
undetectable
2v32B-1sqjA:
undetectable		 2v32A-1sqjA:
14.58
2v32B-1sqjA:
14.58
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.
1ub0 PHOSPHOMETHYLPYRIMID
INE KINASE

(Thermus
thermophilus) 		PF08543
(Phos_pyr_kin) 		5 PRO A 104
THR A 135
PRO A 136
VAL A 170
ALA A 131
 None
 1.40A 2v32A-1ub0A:
undetectable
2v32B-1ub0A:
undetectable		 2v32A-1ub0A:
24.10
2v32B-1ub0A:
24.10
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.
1ur4 GALACTANASE

(Bacillus
licheniformis) 		PF07745
(Glyco_hydro_53) 		4 THR A 254
VAL A 251
SER A 250
ALA A 213
 None
 0.90A 2v32A-1ur4A:
undetectable
2v32B-1ur4A:
undetectable		 2v32A-1ur4A:
21.04
2v32B-1ur4A:
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.
1ur4 GALACTANASE

(Bacillus
licheniformis) 		PF07745
(Glyco_hydro_53) 		4 THR A 254
VAL A 251
SER A 250
GLU A 217
 None
 0.79A 2v32A-1ur4A:
undetectable
2v32B-1ur4A:
undetectable		 2v32A-1ur4A:
21.04
2v32B-1ur4A:
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.
1vcn CTP SYNTHETASE

(Thermus
thermophilus) 		PF00117
(GATase)
PF06418
(CTP_synth_N) 		4 PRO A 535
PRO A 523
SER A 521
ALA A 507
 None
 0.91A 2v32A-1vcnA:
undetectable
2v32B-1vcnA:
undetectable		 2v32A-1vcnA:
18.05
2v32B-1vcnA:
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.
1w78 FOLC BIFUNCTIONAL
PROTEIN

(Escherichia
coli) 		PF02875
(Mur_ligase_C)
PF08245
(Mur_ligase_M) 		4 PRO A  84
VAL A 303
SER A 403
ALA A 408
 PD8  A1421 (-4.5A)
ADP  A1425 (-4.2A)
None
None
 1.01A 2v32A-1w78A:
undetectable
2v32B-1w78A:
undetectable		 2v32A-1w78A:
20.95
2v32B-1w78A:
20.95
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.
1xmj CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR

(Homo sapiens) 		PF00005
(ABC_tran)
PF14396
(CFTR_R) 		4 THR A 438
PRO A 439
VAL A 440
GLU A 621
 None
None
ATP  A   1 (-4.8A)
None
 0.95A 2v32A-1xmjA:
undetectable
2v32B-1xmjA:
undetectable		 2v32A-1xmjA:
21.73
2v32B-1xmjA:
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.
1y25 PROBABLE THIOL
PEROXIDASE

(Mycobacterium
tuberculosis) 		PF08534
(Redoxin) 		5 THR A  57
PRO A  58
VAL A  59
SER A  60
ARG A 130
 ACT  A1200 (-3.6A)
ACT  A1200 (-3.6A)
ACT  A1200 (-3.7A)
ACT  A1200 (-2.8A)
ACT  A1200 (-3.1A)
 0.31A 2v32A-1y25A:
16.3
2v32B-1y25A:
16.4		 2v32A-1y25A:
25.11
2v32B-1y25A:
25.11
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.
1yob FLAVODOXIN 2

(Azotobacter
vinelandii) 		PF00258
(Flavodoxin_1) 		4 PRO A  63
THR A  54
PRO A  55
GLU A 112
 None
None
FMN  A1200 (-4.2A)
None
 1.00A 2v32A-1yobA:
undetectable
2v32B-1yobA:
undetectable		 2v32A-1yobA:
20.78
2v32B-1yobA:
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.
1yzp PEROXIDASE
MANGANESE-DEPENDENT
I

(Phanerochaete
chrysosporium) 		PF00141
(peroxidase)
PF11895
(Peroxidase_ext) 		4 THR A 193
PRO A 194
VAL A 175
SER A 174
 CA  A 371 (-3.6A)
None
None
CA  A 371 (-2.4A)
 0.96A 2v32A-1yzpA:
undetectable
2v32B-1yzpA:
undetectable		 2v32A-1yzpA:
20.83
2v32B-1yzpA:
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.
1zmb ACETYLXYLAN ESTERASE
RELATED ENZYME

(Clostridium
acetobutylicum) 		PF03629
(SASA) 		5 PRO A  50
VAL A  51
SER A  52
GLU A  80
ARG A  16
 None
 1.11A 2v32A-1zmbA:
undetectable
2v32B-1zmbA:
undetectable		 2v32A-1zmbA:
21.97
2v32B-1zmbA:
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.
2a4v PEROXIREDOXIN DOT5

(Saccharomyces
cerevisiae) 		PF00578
(AhpC-TSA) 		4 THR A 104
PRO A 105
SER A 107
ARG A 175
 None
 0.65A 2v32A-2a4vA:
18.1
2v32B-2a4vA:
17.9		 2v32A-2a4vA:
25.32
2v32B-2a4vA:
25.32
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.
2amc PHENYLALANYL-TRNA
SYNTHETASE BETA
CHAIN

(Thermus
thermophilus) 		PF01409
(tRNA-synt_2d)
PF01588
(tRNA_bind)
PF03147
(FDX-ACB)
PF03483
(B3_4)
PF03484
(B5) 		4 PRO B 340
VAL B 341
SER B 342
GLU B 208
 None
 0.98A 2v32A-2amcB:
undetectable
2v32B-2amcB:
undetectable		 2v32A-2amcB:
13.74
2v32B-2amcB:
13.74
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.
2asu HEPATOCYTE GROWTH
FACTOR-LIKE PROTEIN

(Homo sapiens) 		PF00089
(Trypsin) 		4 THR B 495
SER B 510
GLU B 603
ALA B 666
 None
 0.95A 2v32A-2asuB:
undetectable
2v32B-2asuB:
undetectable		 2v32A-2asuB:
18.11
2v32B-2asuB:
18.11
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.
2czc GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE

(Pyrococcus
horikoshii) 		PF01113
(DapB_N)
PF02800
(Gp_dh_C) 		4 THR A 326
SER A 322
GLU A 305
ALA A 123
 None
 0.96A 2v32A-2czcA:
undetectable
2v32B-2czcA:
undetectable		 2v32A-2czcA:
19.54
2v32B-2czcA:
19.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2d7i POLYPEPTIDE
N-ACETYLGALACTOSAMIN
YLTRANSFERASE 10

(Homo sapiens) 		PF00535
(Glycos_transf_2)
PF00652
(Ricin_B_lectin) 		4 PRO A 558
VAL A 559
SER A 560
ALA A 526
 None
 0.76A 2v32A-2d7iA:
2.2
2v32B-2d7iA:
2.2		 2v32A-2d7iA:
18.00
2v32B-2d7iA:
18.00
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.
2ddw PYRIDOXINE KINASE

(Escherichia
coli) 		PF08543
(Phos_pyr_kin) 		5 PRO A 126
THR A 157
PRO A 158
VAL A 192
ALA A 153
 None
 1.46A 2v32A-2ddwA:
undetectable
2v32B-2ddwA:
undetectable		 2v32A-2ddwA:
23.65
2v32B-2ddwA:
23.65
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.
2f2a GLUTAMYL-TRNA(GLN)
AMIDOTRANSFERASE
SUBUNIT A

(Staphylococcus
aureus) 		PF01425
(Amidase) 		4 THR A 429
PRO A 430
VAL A 431
ARG A 180
 None
 1.00A 2v32A-2f2aA:
undetectable
2v32B-2f2aA:
undetectable		 2v32A-2f2aA:
19.13
2v32B-2f2aA:
19.13
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.
2f9f FIRST MANNOSYL
TRANSFERASE (WBAZ-1)

(Archaeoglobus
fulgidus) 		PF00534
(Glycos_transf_1) 		4 PRO A 104
VAL A 117
GLU A  98
ALA A  95
 None
 0.95A 2v32A-2f9fA:
undetectable
2v32B-2f9fA:
undetectable		 2v32A-2f9fA:
26.85
2v32B-2f9fA:
26.85
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.
2i5b PHOSPHOMETHYLPYRIMID
INE KINASE

(Bacillus
subtilis) 		PF08543
(Phos_pyr_kin) 		5 PRO A 108
THR A 139
PRO A 140
VAL A 175
ALA A 135
 None
 1.42A 2v32A-2i5bA:
undetectable
2v32B-2i5bA:
undetectable		 2v32A-2i5bA:
22.30
2v32B-2i5bA:
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.
2kic NITROGENASE GAMMA
SUBUNIT

(Azotobacter
vinelandii) 		PF16844
(DIMCO_N) 		4 PRO A  23
THR A  71
PRO A  72
ALA A  79
 None
 0.90A 2v32A-2kicA:
undetectable
2v32B-2kicA:
undetectable		 2v32A-2kicA:
19.63
2v32B-2kicA:
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.
2o74 OHCU DECARBOXYLASE

(Danio rerio) 		PF09349
(OHCU_decarbox) 		4 THR A  81
PRO A  82
SER A  84
ARG A 161
 None
None
GUN  A1001 (-2.9A)
None
 0.98A 2v32A-2o74A:
undetectable
2v32B-2o74A:
undetectable		 2v32A-2o74A:
23.08
2v32B-2o74A:
23.08
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.
2p10 MLL9387 PROTEIN

(Mesorhizobium
japonicum) 		PF09370
(PEP_hydrolase) 		5 THR A  94
PRO A  95
VAL A  96
GLU A  43
ALA A  40
 None
 1.49A 2v32A-2p10A:
undetectable
2v32B-2p10A:
undetectable		 2v32A-2p10A:
21.74
2v32B-2p10A:
21.74
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.
2p87 PRE-MRNA-SPLICING
FACTOR PRP8

(Caenorhabditis
elegans) 		PF01398
(JAB)
PF08084
(PROCT) 		4 PRO A2142
PRO A2267
VAL A2289
SER A2268
 None
 1.00A 2v32A-2p87A:
undetectable
2v32B-2p87A:
undetectable		 2v32A-2p87A:
18.06
2v32B-2p87A:
18.06
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.
2ri8 MANNOSYL-OLIGOSACCHA
RIDE
ALPHA-1,2-MANNOSIDAS
E

(Penicillium
citrinum) 		PF01532
(Glyco_hydro_47) 		4 THR A1066
PRO A1067
VAL A1068
SER A1069
 None
 0.45A 2v32A-2ri8A:
undetectable
2v32B-2ri8A:
undetectable		 2v32A-2ri8A:
19.08
2v32B-2ri8A:
19.08
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.
2uv8 FATTY ACID SYNTHASE
SUBUNIT BETA (FAS1)

(Saccharomyces
cerevisiae) 		PF00698
(Acyl_transf_1)
PF01575
(MaoC_dehydratas)
PF08354
(DUF1729)
PF13452
(MaoC_dehydrat_N)
PF16073
(SAT) 		5 PRO G1322
THR G1301
VAL G1304
GLU G1594
ALA G1591
 None
 1.32A 2v32A-2uv8G:
undetectable
2v32B-2uv8G:
undetectable		 2v32A-2uv8G:
7.53
2v32B-2uv8G:
7.53
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2v41 PEROXIREDOXIN 6.

(Arenicola
marina) 		PF00578
(AhpC-TSA)
PF10417
(1-cysPrx_C) 		7 THR A  42
PRO A  43
VAL A  44
SER A  45
GLU A 117
ARG A 128
ALA A 147
 BEZ  A1222 (-3.6A)
BEZ  A1222 (-3.2A)
BEZ  A1222 (-3.7A)
BEZ  A1222 (-3.0A)
BEZ  A1222 (-3.6A)
BEZ  A1222 (-3.3A)
BEZ  A1222 ( 3.7A)
 0.17A 2v32A-2v41A:
34.6
2v32B-2v41A:
34.5		 2v32A-2v41A:
100.00
2v32B-2v41A:
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.
2vqd BIOTIN CARBOXYLASE

(Pseudomonas
aeruginosa) 		PF00289
(Biotin_carb_N)
PF02785
(Biotin_carb_C)
PF02786
(CPSase_L_D2) 		4 PRO A 298
VAL A 299
SER A 300
GLU A 211
 None
 1.01A 2v32A-2vqdA:
undetectable
2v32B-2vqdA:
undetectable		 2v32A-2vqdA:
20.60
2v32B-2vqdA:
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.
2wfc PEROXIREDOXIN 5

(Arenicola
marina) 		PF08534
(Redoxin) 		4 THR A  71
PRO A  72
SER A  74
ARG A 152
 None
 0.39A 2v32A-2wfcA:
18.5
2v32B-2wfcA:
18.4		 2v32A-2wfcA:
29.71
2v32B-2wfcA:
29.71
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.
2wk8 CAI-1 AUTOINDUCER
SYNTHASE

(Vibrio cholerae) 		PF00155
(Aminotran_1_2) 		4 PRO A 256
VAL A 255
SER A 259
ALA A 111
 None
 0.92A 2v32A-2wk8A:
undetectable
2v32B-2wk8A:
undetectable		 2v32A-2wk8A:
18.62
2v32B-2wk8A:
18.62
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.
2yyy GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE

(Methanocaldococcus
jannaschii) 		PF01113
(DapB_N)
PF02800
(Gp_dh_C) 		4 THR A 336
SER A 332
GLU A 314
ALA A 126
 None
 1.01A 2v32A-2yyyA:
undetectable
2v32B-2yyyA:
undetectable		 2v32A-2yyyA:
22.67
2v32B-2yyyA:
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.
2yzh PROBABLE THIOL
PEROXIDASE

(Aquifex
aeolicus) 		PF08534
(Redoxin) 		4 THR A  58
PRO A  59
VAL A  60
ARG A 132
 None
 0.63A 2v32A-2yzhA:
15.7
2v32B-2yzhA:
15.7		 2v32A-2yzhA:
25.43
2v32B-2yzhA:
25.43
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2z9s PEROXIREDOXIN-1

(Rattus
norvegicus) 		PF00578
(AhpC-TSA)
PF10417
(1-cysPrx_C) 		4 THR A  49
VAL A  51
SER A  52
ARG A 128
 None
 0.32A 2v32A-2z9sA:
22.5
2v32B-2z9sA:
22.6		 2v32A-2z9sA:
30.17
2v32B-2z9sA:
30.17
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3a5w PROBABLE
PEROXIREDOXIN

(Aeropyrum
pernix) 		PF00578
(AhpC-TSA)
PF10417
(1-cysPrx_C) 		4 THR A  47
PRO A  48
VAL A  49
ARG A 126
 None
 0.23A 2v32A-3a5wA:
22.4
2v32B-3a5wA:
22.3		 2v32A-3a5wA:
33.20
2v32B-3a5wA:
33.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3akf PUTATIVE SECRETED
ALPHA
L-ARABINOFURANOSIDAS
E II

(Streptomyces
avermitilis) 		PF04616
(Glyco_hydro_43)
PF05270
(AbfB) 		4 PRO A 177
THR A 127
PRO A 128
VAL A 129
 None
 0.76A 2v32A-3akfA:
undetectable
2v32B-3akfA:
undetectable		 2v32A-3akfA:
20.97
2v32B-3akfA:
20.97
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.
3akf PUTATIVE SECRETED
ALPHA
L-ARABINOFURANOSIDAS
E II

(Streptomyces
avermitilis) 		PF04616
(Glyco_hydro_43)
PF05270
(AbfB) 		4 PRO A 375
THR A 253
VAL A 315
ALA A 351
 None
 1.01A 2v32A-3akfA:
undetectable
2v32B-3akfA:
undetectable		 2v32A-3akfA:
20.97
2v32B-3akfA:
20.97
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.
3d9r KETOSTEROID
ISOMERASE-LIKE
PROTEIN

(Pectobacterium
atrosepticum) 		PF12680
(SnoaL_2) 		4 THR A  65
VAL A  62
SER A  61
ARG A  46
 None
 0.84A 2v32A-3d9rA:
undetectable
2v32B-3d9rA:
undetectable		 2v32A-3d9rA:
21.58
2v32B-3d9rA:
21.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3drn PEROXIREDOXIN,
BACTERIOFERRITIN
COMIGRATORY PROTEIN
HOMOLOG

(Sulfolobus
solfataricus) 		PF00578
(AhpC-TSA) 		4 THR A  42
PRO A  43
SER A  45
ARG A 112
 CIT  A 500 (-2.9A)
CIT  A 500 (-3.6A)
CIT  A 500 (-2.5A)
CIT  A 500 (-3.7A)
 0.57A 2v32A-3drnA:
19.3
2v32B-3drnA:
19.5		 2v32A-3drnA:
27.78
2v32B-3drnA:
27.78
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.
3dtt NADP OXIDOREDUCTASE

(Arthrobacter
sp. FB24) 		PF03807
(F420_oxidored) 		4 PRO A 120
PRO A 107
GLU A 128
ALA A 198
 None
 0.88A 2v32A-3dttA:
undetectable
2v32B-3dttA:
undetectable		 2v32A-3dttA:
22.51
2v32B-3dttA:
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.
3e2s PROLINE
DEHYDROGENASE

(Escherichia
coli) 		PF01619
(Pro_dh)
PF14850
(Pro_dh-DNA_bdg) 		4 THR A 462
VAL A 464
SER A 465
GLU A 103
 FAD  A2001 (-3.4A)
None
None
None
 1.00A 2v32A-3e2sA:
undetectable
2v32B-3e2sA:
undetectable		 2v32A-3e2sA:
19.96
2v32B-3e2sA:
19.96
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.
3g0t PUTATIVE
AMINOTRANSFERASE

(Porphyromonas
gingivalis) 		PF00155
(Aminotran_1_2) 		4 PRO A 140
THR A 194
PRO A 193
ALA A 409
 None
 0.98A 2v32A-3g0tA:
undetectable
2v32B-3g0tA:
undetectable		 2v32A-3g0tA:
19.86
2v32B-3g0tA:
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.
3hjp PEROXIREDOXIN,
BACTERIOFERRITIN
COMIGRATORY PROTEIN
HOMOLOG (BCP-4)

(Sulfolobus
solfataricus) 		PF00578
(AhpC-TSA) 		4 THR A  42
VAL A  44
SER A  45
ARG A 119
 CL  A 700 (-3.2A)
None
CL  A 700 (-3.0A)
CL  A 700 (-3.5A)
 0.47A 2v32A-3hjpA:
21.0
2v32B-3hjpA:
21.0		 2v32A-3hjpA:
26.81
2v32B-3hjpA:
26.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3hn0 NITRATE TRANSPORT
PROTEIN

(Parabacteroides
distasonis) 		no annotation 4 THR A 252
PRO A 253
SER A 255
ARG A 258
 None
 0.99A 2v32A-3hn0A:
undetectable
2v32B-3hn0A:
undetectable		 2v32A-3hn0A:
21.58
2v32B-3hn0A:
21.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3i4x TRYPTOPHAN
DIMETHYLALLYLTRANSFE
RASE

(Aspergillus
fumigatus) 		PF11991
(Trp_DMAT) 		4 PRO A  70
THR A  86
PRO A  87
GLU A 418
 None
 0.97A 2v32A-3i4xA:
undetectable
2v32B-3i4xA:
undetectable		 2v32A-3i4xA:
17.97
2v32B-3i4xA:
17.97
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.
3i9v NADH-QUINONE
OXIDOREDUCTASE
SUBUNIT 3

(Thermus
thermophilus) 		PF00384
(Molybdopterin)
PF01568
(Molydop_binding)
PF04879
(Molybdop_Fe4S4)
PF10588
(NADH-G_4Fe-4S_3)
PF13510
(Fer2_4) 		4 PRO 3 423
THR 3 430
PRO 3 431
GLU 3 287
 None
 0.84A 2v32A-3i9v3:
undetectable
2v32B-3i9v3:
undetectable		 2v32A-3i9v3:
16.09
2v32B-3i9v3:
16.09
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.
3ldr FRUCTOSYLTRANSFERASE

(Aspergillus
japonicus) 		PF00251
(Glyco_hydro_32N)
PF08244
(Glyco_hydro_32C) 		4 PRO A  68
PRO A 124
VAL A 122
ALA A 161
 None
 0.96A 2v32A-3ldrA:
undetectable
2v32B-3ldrA:
undetectable		 2v32A-3ldrA:
14.98
2v32B-3ldrA:
14.98
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.
3lul 4-AMINO-4-DEOXYCHORI
SMATE LYASE

(Legionella
pneumophila) 		PF01063
(Aminotran_4) 		4 THR A   3
PRO A   2
SER A 105
ALA A  53
 None
 0.91A 2v32A-3lulA:
undetectable
2v32B-3lulA:
undetectable		 2v32A-3lulA:
22.55
2v32B-3lulA:
22.55
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.
3m1l 3-OXOACYL-(ACYL-CARR
IER-PROTEIN)
REDUCTASE

(Mycobacterium
tuberculosis) 		PF13561
(adh_short_C2) 		4 PRO A 204
PRO A 434
SER A 436
GLU A 175
 None
 0.99A 2v32A-3m1lA:
undetectable
2v32B-3m1lA:
undetectable		 2v32A-3m1lA:
19.50
2v32B-3m1lA:
19.50
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.
3m7a UNCHARACTERIZED
PROTEIN

(Novosphingobium
aromaticivorans) 		PF02643
(DUF192) 		5 PRO A  41
VAL A  42
SER A  43
GLU A  86
ARG A  79
 None
 1.19A 2v32A-3m7aA:
undetectable
2v32B-3m7aA:
undetectable		 2v32A-3m7aA:
22.51
2v32B-3m7aA:
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.
3mbh PUTATIVE
PHOSPHOMETHYLPYRIMID
INE KINASE

(Bacteroides
thetaiotaomicron) 		PF08543
(Phos_pyr_kin) 		5 PRO A 112
THR A 143
PRO A 144
VAL A 181
ALA A 139
 None
 1.48A 2v32A-3mbhA:
undetectable
2v32B-3mbhA:
undetectable		 2v32A-3mbhA:
23.97
2v32B-3mbhA:
23.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3myf SENSOR PROTEIN

(Shewanella sp.
W3-18-1) 		PF01627
(Hpt) 		4 THR A 890
PRO A 891
VAL A 892
GLU A 898
 None
 0.99A 2v32A-3myfA:
undetectable
2v32B-3myfA:
undetectable		 2v32A-3myfA:
20.09
2v32B-3myfA:
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.
3n0t DIPEPTIDYL PEPTIDASE
2

(Homo sapiens) 		PF05577
(Peptidase_S28) 		4 PRO A 275
PRO A 455
VAL A 458
ARG A 462
 None
 0.93A 2v32A-3n0tA:
undetectable
2v32B-3n0tA:
undetectable		 2v32A-3n0tA:
19.57
2v32B-3n0tA:
19.57
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.
3q75 FARNESYLTRANSFERASE
BETA SUBUNIT

(Cryptococcus
neoformans) 		PF00432
(Prenyltrans) 		4 THR B 498
PRO B 499
VAL B 500
ALA B 474
 None
 0.76A 2v32A-3q75B:
undetectable
2v32B-3q75B:
undetectable		 2v32A-3q75B:
16.63
2v32B-3q75B:
16.63
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.
3rko NADH-QUINONE
OXIDOREDUCTASE
SUBUNIT L

(Escherichia
coli) 		no annotation 4 THR L 247
PRO L 248
VAL L 249
SER L 250
 None
 0.87A 2v32A-3rkoL:
undetectable
2v32B-3rkoL:
undetectable		 2v32A-3rkoL:
15.99
2v32B-3rkoL:
15.99
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.
3sbc PEROXIREDOXIN TSA1

(Saccharomyces
cerevisiae) 		PF00578
(AhpC-TSA)
PF10417
(1-cysPrx_C) 		4 THR A  44
VAL A  46
SER A  47
ARG A 123
 None
 0.36A 2v32A-3sbcA:
21.2
2v32B-3sbcA:
21.4		 2v32A-3sbcA:
24.69
2v32B-3sbcA:
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.
3sjn MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN

(Shewanella
pealeana) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		4 PRO A 227
VAL A 228
SER A 201
ALA A 230
 None
 0.94A 2v32A-3sjnA:
undetectable
2v32B-3sjnA:
undetectable		 2v32A-3sjnA:
21.84
2v32B-3sjnA:
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.
3sno HYPOTHETICAL
AMINOTRANSFERASE

(Corynebacterium
glutamicum) 		PF01063
(Aminotran_4) 		4 THR A 129
PRO A 130
VAL A 131
SER A 107
 None
 0.96A 2v32A-3snoA:
undetectable
2v32B-3snoA:
undetectable		 2v32A-3snoA:
20.67
2v32B-3snoA:
20.67
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.
3t2y SULFIDE-QUINONE
REDUCTASE, PUTATIVE

(Acidithiobacillus
ferrooxidans) 		PF07992
(Pyr_redox_2) 		4 THR A 312
PRO A 313
VAL A 314
GLU A 193
 None
 0.85A 2v32A-3t2yA:
undetectable
2v32B-3t2yA:
undetectable		 2v32A-3t2yA:
19.59
2v32B-3t2yA:
19.59
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3tb2 1-CYS PEROXIREDOXIN

(Plasmodium
yoelii) 		PF00578
(AhpC-TSA)
PF10417
(1-cysPrx_C) 		6 THR A  44
PRO A  45
VAL A  46
GLU A 118
ARG A 129
ALA A 148
 GOL  A 223 ( 4.3A)
GOL  A 223 (-3.6A)
GOL  A 223 (-3.7A)
GOL  A 223 (-3.4A)
GOL  A 223 (-4.1A)
GOL  A 223 (-3.6A)
 0.49A 2v32A-3tb2A:
30.0
2v32B-3tb2A:
30.3		 2v32A-3tb2A:
45.34
2v32B-3tb2A:
45.34
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.
3u0b OXIDOREDUCTASE,
SHORT CHAIN
DEHYDROGENASE/REDUCT
ASE FAMILY PROTEIN

(Mycolicibacterium
smegmatis) 		PF13561
(adh_short_C2) 		4 PRO A 200
PRO A 430
SER A 432
GLU A 171
 None
 1.00A 2v32A-3u0bA:
undetectable
2v32B-3u0bA:
undetectable		 2v32A-3u0bA:
21.56
2v32B-3u0bA:
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.
3v94 CYCLIC NUCLEOTIDE
SPECIFIC
PHOSPHODIESTERASE

(Trypanosoma
cruzi) 		PF00233
(PDEase_I) 		4 PRO A 284
PRO A 427
VAL A 428
SER A 429
 None
 0.82A 2v32A-3v94A:
undetectable
2v32B-3v94A:
undetectable		 2v32A-3v94A:
20.17
2v32B-3v94A:
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.
3zs7 PYRIDOXAL KINASE

(Trypanosoma
brucei) 		PF08543
(Phos_pyr_kin) 		5 PRO A 118
THR A 147
PRO A 148
VAL A 182
ALA A 143
 None
 1.49A 2v32A-3zs7A:
undetectable
2v32B-3zs7A:
undetectable		 2v32A-3zs7A:
22.51
2v32B-3zs7A:
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.
4af2 THIOL PEROXIDASE

(Escherichia
coli) 		PF08534
(Redoxin) 		4 THR A  58
VAL A  60
SER A  61
ARG A 133
 None
 0.29A 2v32A-4af2A:
16.5
2v32B-4af2A:
16.7		 2v32A-4af2A:
24.90
2v32B-4af2A:
24.90
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.
4bm1 MANGANESE PEROXIDASE
4

(Pleurotus
ostreatus) 		PF00141
(peroxidase)
PF11895
(Peroxidase_ext) 		4 THR A 196
PRO A 197
VAL A 178
ALA A 122
 CA  A 402 (-3.6A)
None
None
None
 1.00A 2v32A-4bm1A:
undetectable
2v32B-4bm1A:
undetectable		 2v32A-4bm1A:
22.09
2v32B-4bm1A:
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.
4bm1 MANGANESE PEROXIDASE
4

(Pleurotus
ostreatus) 		PF00141
(peroxidase)
PF11895
(Peroxidase_ext) 		4 THR A 196
PRO A 197
VAL A 178
SER A 177
 CA  A 402 (-3.6A)
None
None
CA  A 402 (-2.4A)
 0.97A 2v32A-4bm1A:
undetectable
2v32B-4bm1A:
undetectable		 2v32A-4bm1A:
22.09
2v32B-4bm1A:
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.
4c5n PHOSPHOMETHYLPYRIMID
INE KINASE

(Staphylococcus
aureus) 		PF08543
(Phos_pyr_kin) 		5 PRO A 106
THR A 137
PRO A 138
VAL A 173
ALA A 133
 None
 1.39A 2v32A-4c5nA:
undetectable
2v32B-4c5nA:
undetectable		 2v32A-4c5nA:
23.69
2v32B-4c5nA:
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.
4dqd EXTRACELLULAR
LIGAND-BINDING
RECEPTOR

(Rhodopseudomonas
palustris) 		PF13458
(Peripla_BP_6) 		4 THR A  96
PRO A  97
VAL A  98
SER A  99
 PPY  A 401 (-3.9A)
PPY  A 401 (-4.7A)
None
None
 0.87A 2v32A-4dqdA:
undetectable
2v32B-4dqdA:
undetectable		 2v32A-4dqdA:
21.25
2v32B-4dqdA:
21.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4g2b SECRETED EFFECTOR
PROTEIN SSEI

(Salmonella
enterica) 		PF15645
(Tox-PLDMTX) 		4 THR A 183
PRO A 184
VAL A 185
SER A 186
 None
 0.98A 2v32A-4g2bA:
undetectable
2v32B-4g2bA:
undetectable		 2v32A-4g2bA:
21.25
2v32B-4g2bA:
21.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4hea NADH-QUINONE
OXIDOREDUCTASE
SUBUNIT 12

(Thermus
thermophilus) 		PF00361
(Proton_antipo_M)
PF00662
(Proton_antipo_N) 		4 THR L 234
PRO L 235
VAL L 236
SER L 237
 None
 0.76A 2v32A-4heaL:
undetectable
2v32B-4heaL:
undetectable		 2v32A-4heaL:
14.52
2v32B-4heaL:
14.52
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.
4ixu ARGINASE-2,
MITOCHONDRIAL

(Homo sapiens) 		PF00491
(Arginase) 		4 PRO A 163
VAL A 164
SER A 165
GLU A 205
 None
None
None
38I  A 406 ( 4.0A)
 0.99A 2v32A-4ixuA:
undetectable
2v32B-4ixuA:
undetectable		 2v32A-4ixuA:
20.87
2v32B-4ixuA:
20.87
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.
4jjp PHOSPHOMETHYLPYRIMID
INE KINASE

(Clostridioides
difficile) 		PF08543
(Phos_pyr_kin) 		5 PRO A 108
THR A 139
PRO A 140
VAL A 174
ALA A 135
 None
 1.44A 2v32A-4jjpA:
undetectable
2v32B-4jjpA:
undetectable		 2v32A-4jjpA:
21.71
2v32B-4jjpA:
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.
4kbo STRESS-70 PROTEIN,
MITOCHONDRIAL

(Homo sapiens) 		PF00012
(HSP70) 		4 PRO A 141
PRO A 113
VAL A 110
ARG A 309
 None
 0.94A 2v32A-4kboA:
undetectable
2v32B-4kboA:
undetectable		 2v32A-4kboA:
21.94
2v32B-4kboA:
21.94
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.
4m6t RNA POLYMERASE
II-ASSOCIATED FACTOR
1 HOMOLOG, LINKER,
RNA
POLYMERASE-ASSOCIATE
D PROTEIN LEO1

(Homo sapiens) 		PF03985
(Paf1)
PF04004
(Leo1) 		4 THR A  40
PRO A  41
VAL A  42
SER A 174
 None
SAM  A 201 (-4.7A)
SAM  A 201 (-3.8A)
None
 0.99A 2v32A-4m6tA:
undetectable
2v32B-4m6tA:
undetectable		 2v32A-4m6tA:
24.18
2v32B-4m6tA:
24.18
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.
4ncc FAB FRAGMENT HEAVY
FAB FRAGMENT LIGHT

(Mus musculus;
Mus musculus) 		no annotation
no annotation 		4 PRO L  94
THR H  61
PRO H  62
SER H  63
 None
 0.84A 2v32A-4nccL:
undetectable
2v32B-4nccL:
undetectable		 2v32A-4nccL:
20.72
2v32B-4nccL:
20.72
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.
4nl4 PRIMOSOME ASSEMBLY
PROTEIN PRIA

(Klebsiella
pneumoniae) 		PF00270
(DEAD)
PF00271
(Helicase_C) 		4 THR H 308
PRO H 309
GLU H 273
ALA H 296
 None
 0.73A 2v32A-4nl4H:
undetectable
2v32B-4nl4H:
undetectable		 2v32A-4nl4H:
15.77
2v32B-4nl4H:
15.77
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.
4omu SHIKIMATE
DEHYDROGENASE

(Pseudomonas
putida) 		PF01488
(Shikimate_DH)
PF08501
(Shikimate_dh_N) 		4 PRO A 262
VAL A 263
GLU A 244
ALA A 243
 None
 0.91A 2v32A-4omuA:
undetectable
2v32B-4omuA:
undetectable		 2v32A-4omuA:
22.84
2v32B-4omuA:
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.
4ru0 PUTATIVE
BRANCHED-CHAIN AMINO
ACID ABC
TRANSPORTER,
PERIPLASMIC
BRANCHED-CHAIN AMINO
ACID-BINDING PROTEIN

(Pseudomonas
protegens) 		PF13458
(Peripla_BP_6) 		4 THR A 244
PRO A 245
VAL A 242
SER A 243
 None
 0.93A 2v32A-4ru0A:
undetectable
2v32B-4ru0A:
undetectable		 2v32A-4ru0A:
18.22
2v32B-4ru0A:
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.
4rye D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE

(Mycobacterium
tuberculosis) 		PF00768
(Peptidase_S11) 		4 THR A 162
PRO A 163
SER A 164
ALA A  98
 None
 0.95A 2v32A-4ryeA:
undetectable
2v32B-4ryeA:
undetectable		 2v32A-4ryeA:
22.90
2v32B-4ryeA:
22.90
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.
4uyb SEC14-LIKE PROTEIN 3

(Homo sapiens) 		PF00650
(CRAL_TRIO) 		4 THR A 398
PRO A 399
VAL A 400
GLU A 156
 None
None
None
EDO  A1401 ( 4.4A)
 0.95A 2v32A-4uybA:
undetectable
2v32B-4uybA:
undetectable		 2v32A-4uybA:
19.55
2v32B-4uybA:
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.
4yio SUPEROXIDE DISMUTASE

(Streptococcus
thermophilus) 		PF00081
(Sod_Fe_N)
PF02777
(Sod_Fe_C) 		5 PRO A 157
THR A 149
PRO A 150
SER A 152
GLU A  53
 None
 1.28A 2v32A-4yioA:
undetectable
2v32B-4yioA:
undetectable		 2v32A-4yioA:
21.96
2v32B-4yioA:
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.
4yip SUPEROXIDE DISMUTASE
[MN/FE]

(Streptococcus
mutans) 		PF00081
(Sod_Fe_N)
PF02777
(Sod_Fe_C) 		4 THR A 149
PRO A 150
SER A 152
GLU A  53
 None
 0.95A 2v32A-4yipA:
undetectable
2v32B-4yipA:
undetectable		 2v32A-4yipA:
24.30
2v32B-4yipA:
24.30
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.
4ywr PUTATIVE
HYDROXYMETHYLPYRIMID
INE
KINASE/PHOSPHOMETHYL
PYRIMIDINE KINASE

(Acinetobacter
baumannii) 		PF08543
(Phos_pyr_kin) 		5 PRO A 113
THR A 144
PRO A 145
VAL A 174
ALA A 140
 None
 1.39A 2v32A-4ywrA:
undetectable
2v32B-4ywrA:
undetectable		 2v32A-4ywrA:
23.78
2v32B-4ywrA:
23.78
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.
4zoh PUTATIVE
OXIDOREDUCTASE
MOLYBDOPTERIN-BINDIN
G SUBUNIT

(Sulfurisphaera
tokodaii) 		PF01315
(Ald_Xan_dh_C)
PF02738
(Ald_Xan_dh_C2) 		4 PRO A 243
VAL A 242
GLU A 225
ALA A 170
 None
 0.87A 2v32A-4zohA:
undetectable
2v32B-4zohA:
undetectable		 2v32A-4zohA:
16.81
2v32B-4zohA:
16.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5cj5 ALPHA-1,4-GLUCAN:MAL
TOSE-1-PHOSPHATE
MALTOSYLTRANSFERASE

(Mycolicibacterium
thermoresistibile) 		PF00128
(Alpha-amylase)
PF11896
(DUF3416) 		4 THR A 107
PRO A 108
VAL A  25
GLU A 589
 None
 0.97A 2v32A-5cj5A:
undetectable
2v32B-5cj5A:
undetectable		 2v32A-5cj5A:
16.69
2v32B-5cj5A:
16.69
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.
5djw ALPHA-GLUCOSIDASE II

(Bacteroides
thetaiotaomicron) 		PF01055
(Glyco_hydro_31)
PF13802
(Gal_mutarotas_2)
PF17137
(DUF5110) 		4 PRO A 414
VAL A 413
GLU A 525
ALA A 528
 None
 0.96A 2v32A-5djwA:
undetectable
2v32B-5djwA:
undetectable		 2v32A-5djwA:
16.38
2v32B-5djwA:
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.
5e43 BETA-LACTAMASE

(Streptosporangium
roseum) 		PF13354
(Beta-lactamase2) 		4 THR A 183
PRO A 184
SER A 186
ARG A 189
 ACT  A 307 (-3.1A)
None
ACT  A 307 (-3.1A)
ACT  A 307 (-3.4A)
 0.87A 2v32A-5e43A:
undetectable
2v32B-5e43A:
undetectable		 2v32A-5e43A:
20.32
2v32B-5e43A:
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.
5h1k GEM-ASSOCIATED
PROTEIN 5

(Homo sapiens) 		PF00400
(WD40)
PF12894
(ANAPC4_WD40) 		4 PRO A 631
THR A 634
VAL A 608
SER A 636
 None
 0.94A 2v32A-5h1kA:
undetectable
2v32B-5h1kA:
undetectable		 2v32A-5h1kA:
17.39
2v32B-5h1kA:
17.39
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.
5j9c PEROXIREDOXIN ASP F3

(Aspergillus
fumigatus) 		PF08534
(Redoxin) 		5 THR A  58
PRO A  59
VAL A  60
SER A  61
ARG A 134
 None
 0.33A 2v32A-5j9cA:
17.5
2v32B-5j9cA:
17.5		 2v32A-5j9cA:
25.00
2v32B-5j9cA:
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.
5k7l POTASSIUM
VOLTAGE-GATED
CHANNEL SUBFAMILY H
MEMBER 1

(Rattus
norvegicus) 		PF00027
(cNMP_binding)
PF00520
(Ion_trans)
PF13426
(PAS_9) 		4 THR A 105
PRO A 106
VAL A 107
ALA A 157
 None
 0.93A 2v32A-5k7lA:
undetectable
2v32B-5k7lA:
undetectable		 2v32A-5k7lA:
14.24
2v32B-5k7lA:
14.24
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.
5mll DNA PROCESSING CHAIN
A (DPRA)

(Helicobacter
pylori) 		no annotation 4 THR A  55
PRO A  56
SER A  58
GLU A 188
 None
 1.00A 2v32A-5mllA:
undetectable
2v32B-5mllA:
undetectable		 2v32A-5mllA:
undetectable
2v32B-5mllA:
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.
5npx POLYPROTEIN

(Broad bean
stain virus) 		no annotation 4 THR S 430
PRO S 431
VAL S 432
SER S 433
 None
 0.85A 2v32A-5npxS:
undetectable
2v32B-5npxS:
undetectable		 2v32A-5npxS:
undetectable
2v32B-5npxS:
undetectable