SIMILAR PATTERNS OF AMINO ACIDS FOR 1MJ2_C_SAMC1200

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.
1brw PROTEIN (PYRIMIDINE
NUCLEOSIDE
PHOSPHORYLASE)

(Geobacillus
stearothermophilus) 		PF00591
(Glycos_transf_3)
PF02885
(Glycos_trans_3N)
PF07831
(PYNP_C) 		5 GLU A 297
ARG A 293
LEU A 273
GLU A 270
HIS A 266
 None
 0.79A 1mj2C-1brwA:
undetectable		 1mj2C-1brwA:
15.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1dk5 ANNEXIN 24(CA32)

(Capsicum annuum) 		PF00191
(Annexin) 		5 ARG A  58
ARG A  54
GLU A 279
ALA A 275
PRO A  92
 None
 1.19A 1mj2C-1dk5A:
undetectable		 1mj2C-1dk5A:
17.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ksp PROTEIN (DNA
POLYMERASE I-KLENOW
FRAGMENT
(E.C.2.7.7.7))

(Escherichia
coli) 		PF00476
(DNA_pol_A)
PF01612
(DNA_pol_A_exo1) 		5 GLU A 685
ARG A 688
LEU A 636
ALA A 634
LEU A 563
 None
 1.31A 1mj2C-1kspA:
undetectable		 1mj2C-1kspA:
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.
1m6y S-ADENOSYL-METHYLTRA
NSFERASE MRAW

(Thermotoga
maritima) 		PF01795
(Methyltransf_5) 		5 GLU A 195
ARG A 198
ARG A 199
GLU A 160
ALA A 164
 None
 1.36A 1mj2C-1m6yA:
0.7		 1mj2C-1m6yA:
17.28
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1mjl METHIONINE REPRESSOR
PROTEIN METJ

(Escherichia
coli) 		PF01340
(MetJ) 		9 GLU A  39
ARG A  42
ARG A  43
LEU A  56
GLU A  59
ALA A  60
HIS A  63
LEU A  70
PRO A  71
 None
None
None
None
None
None
SAM  A 200 ( 2.9A)
None
None
 0.32A 1mj2C-1mjlA:
13.7		 1mj2C-1mjlA:
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.
1pko MYELIN
OLIGODENDROCYTE
GLYCOPROTEIN

(Rattus
norvegicus) 		PF07686
(V-set) 		5 GLU A  36
ARG A 101
ARG A  52
LEU A  50
GLU A  60
 None
 1.18A 1mj2C-1pkoA:
undetectable		 1mj2C-1pkoA:
23.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1u0x NITROPHORIN 4

(Rhodnius
prolixus) 		PF02087
(Nitrophorin) 		5 ARG A 139
LEU A  44
GLU A  55
ALA A  56
LEU A 182
 None
XE  A 187 ( 4.7A)
None
None
None
 1.40A 1mj2C-1u0xA:
undetectable		 1mj2C-1u0xA:
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.
2hi0 PUTATIVE
PHOSPHOGLYCOLATE
PHOSPHATASE

(Lactobacillus
delbrueckii) 		PF13419
(HAD_2) 		5 GLU A  88
ARG A  91
LEU A  59
GLU A  62
ALA A  63
 None
 0.84A 1mj2C-2hi0A:
undetectable		 1mj2C-2hi0A:
17.98
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.
2lz1 NUCLEAR FACTOR
ERYTHROID 2-RELATED
FACTOR 2

(Homo sapiens) 		PF03131
(bZIP_Maf) 		5 ARG A  84
LEU A  17
GLU A  18
ALA A  19
LEU A  21
 None
 1.30A 1mj2C-2lz1A:
undetectable		 1mj2C-2lz1A:
22.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2w4g MYOSIN HEAVY CHAIN,
SKELETAL MUSCLE,
ADULT

(Gallus gallus) 		PF00063
(Myosin_head)
PF02736
(Myosin_N) 		5 GLU M 502
ARG M 714
GLU M 499
HIS M 494
LEU M 498
 None
 1.48A 1mj2C-2w4gM:
undetectable		 1mj2C-2w4gM:
8.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2x3n PROBABLE
FAD-DEPENDENT
MONOOXYGENASE

(Pseudomonas
aeruginosa) 		PF01494
(FAD_binding_3) 		5 GLU A  65
ARG A  68
ARG A  69
LEU A 111
GLU A 114
 None
 1.14A 1mj2C-2x3nA:
undetectable		 1mj2C-2x3nA:
14.03
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.
2y4r 4-AMINO-4-DEOXYCHORI
SMATE LYASE

(Pseudomonas
aeruginosa) 		PF01063
(Aminotran_4) 		5 GLU A  49
ARG A  52
ARG A  53
LEU A 139
ALA A 198
 PG4  A1272 (-3.6A)
None
PG4  A1272 ( 4.5A)
None
PG4  A1272 ( 4.1A)
 1.24A 1mj2C-2y4rA:
undetectable		 1mj2C-2y4rA:
16.85
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.
2y7j PHOSPHORYLASE B
KINASE GAMMA
CATALYTIC CHAIN,
TESTIS/LIVER ISOFORM

(Homo sapiens) 		PF00069
(Pkinase) 		5 GLU A 139
LEU A 286
GLU A 283
ALA A 282
HIS A 145
 None
 1.22A 1mj2C-2y7jA:
undetectable		 1mj2C-2y7jA:
15.73
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.
2yys PROLINE
IMINOPEPTIDASE-RELAT
ED PROTEIN

(Thermus
thermophilus) 		PF12697
(Abhydrolase_6) 		5 GLU A 111
ARG A 114
ARG A 115
GLU A  83
ALA A  80
 None
 1.43A 1mj2C-2yysA:
undetectable		 1mj2C-2yysA:
16.99
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.
3bo5 HISTONE-LYSINE
N-METHYLTRANSFERASE
SETMAR

(Homo sapiens) 		PF00856
(SET)
PF05033
(Pre-SET) 		5 GLU A 163
ARG A 166
ARG A 167
LEU A 159
GLU A 157
 None
 0.89A 1mj2C-3bo5A:
undetectable		 1mj2C-3bo5A:
14.08
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.
3c8e YGHU, GLUTATHIONE
S-TRANSFERASE
HOMOLOGUE

(Escherichia
coli) 		PF02798
(GST_N)
PF13410
(GST_C_2) 		5 GLU A  63
ARG A 254
ARG A 272
GLU A  74
ALA A  73
 None
 1.44A 1mj2C-3c8eA:
undetectable		 1mj2C-3c8eA:
18.52
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.
3d36 SPORULATION KINASE B

(Geobacillus
stearothermophilus) 		PF00512
(HisKA)
PF02518
(HATPase_c) 		5 GLU A 279
ARG A 282
ARG A 311
LEU A 274
GLU A 272
 None
 1.42A 1mj2C-3d36A:
undetectable		 1mj2C-3d36A:
18.61
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.
3gfm 146AA LONG
HYPOTHETICAL
TRANSCRIPTIONAL
REGULATOR

(Sulfurisphaera
tokodaii) 		PF13463
(HTH_27) 		5 GLU A  25
ARG A  28
ARG A  29
LEU A 114
GLU A 117
 None
 1.01A 1mj2C-3gfmA:
undetectable		 1mj2C-3gfmA:
20.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3gue UTP-GLUCOSE-1-PHOSPH
ATE
URIDYLYLTRANSFERASE
2

(Trypanosoma
brucei) 		PF01704
(UDPGP) 		5 GLU A 279
LEU A 277
ALA A 354
LEU A 325
PRO A 326
 UPG  A 484 (-2.7A)
UPG  A 484 ( 4.9A)
None
None
None
 1.31A 1mj2C-3gueA:
undetectable		 1mj2C-3gueA:
12.55
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.
3hdo HISTIDINOL-PHOSPHATE
AMINOTRANSFERASE

(Geobacter
metallireducens) 		PF00155
(Aminotran_1_2) 		5 GLU A 188
ARG A 208
LEU A 261
ALA A 254
LEU A 255
 None
 1.47A 1mj2C-3hdoA:
undetectable		 1mj2C-3hdoA:
16.62
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.
3j9e VP5

(Bluetongue
virus) 		PF00901
(Orbi_VP5) 		5 GLU D 427
ARG D 423
GLU D 405
HIS D 380
LEU D 407
 None
 1.45A 1mj2C-3j9eD:
undetectable		 1mj2C-3j9eD:
13.66
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.
3npi TETR FAMILY
REGULATORY PROTEIN

(Corynebacterium
diphtheriae) 		PF00440
(TetR_N) 		5 GLU A  71
ARG A  74
ARG A  75
LEU A  27
ALA A  26
 None
SO4  A 257 (-2.8A)
None
None
None
 1.12A 1mj2C-3npiA:
undetectable		 1mj2C-3npiA:
18.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3pbk FATTY ACYL-ADENYLATE
LIGASE

(Escherichia
coli) 		PF00501
(AMP-binding) 		5 ARG A 514
LEU A 518
GLU A 483
ALA A 480
PRO A 484
 None
 1.31A 1mj2C-3pbkA:
undetectable		 1mj2C-3pbkA:
13.59
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.
3t6p BACULOVIRAL IAP
REPEAT-CONTAINING
PROTEIN 2

(Homo sapiens) 		PF00619
(CARD)
PF00653
(BIR)
PF13920
(zf-C3HC4_3) 		5 GLU A 560
ARG A 563
ARG A 564
LEU A 556
GLU A 551
 None
 1.02A 1mj2C-3t6pA:
undetectable		 1mj2C-3t6pA:
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.
3zh2 L-LACTATE
DEHYDROGENASE

(Plasmodium
falciparum) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		5 GLU A 308
ARG A 311
ALA A 181
HIS A 182
PRO A 128
 None
 1.34A 1mj2C-3zh2A:
undetectable		 1mj2C-3zh2A:
14.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4acj WU:FB25H12 PROTEIN,

(Danio rerio) 		PF07534
(TLD) 		5 ARG A 657
GLU A 721
ALA A 706
LEU A 705
PRO A 655
 None
 1.45A 1mj2C-4acjA:
undetectable		 1mj2C-4acjA:
22.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4hh8 BUTYROPHILIN
SUBFAMILY 1 MEMBER
A1

(Bos taurus) 		PF07686
(V-set)
PF08205
(C2-set_2) 		5 GLU A  36
ARG A 101
ARG A  52
LEU A  50
GLU A  60
 None
 1.20A 1mj2C-4hh8A:
undetectable		 1mj2C-4hh8A:
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.
4kf7 NUP188

(Thermothelomyces
thermophila) 		PF10487
(Nup188) 		5 GLU A1124
ARG A1121
ARG A1072
LEU A1115
ALA A1113
 None
 1.50A 1mj2C-4kf7A:
undetectable		 1mj2C-4kf7A:
5.97
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.
4knh NUP192P

(Chaetomium
thermophilum) 		PF11894
(Nup192) 		5 GLU A 128
ARG A 124
LEU A   7
GLU A   8
ALA A   9
 None
 1.32A 1mj2C-4knhA:
0.7		 1mj2C-4knhA:
7.84
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.
4o5f TYPE III
PANTOTHENATE KINASE

(Burkholderia
thailandensis) 		PF03309
(Pan_kinase) 		5 GLU A 131
LEU A 107
ALA A 110
HIS A 244
LEU A 247
 None
None
None
GOL  A 307 (-3.9A)
None
 1.30A 1mj2C-4o5fA:
undetectable		 1mj2C-4o5fA:
16.13
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.
4p7w L-PROLINE
CIS-4-HYDROXYLASE

(Mesorhizobium
japonicum) 		PF05118
(Asp_Arg_Hydrox)
PF05373
(Pro_3_hydrox_C) 		5 GLU A 247
ARG A 250
ARG A 251
LEU A 209
GLU A 206
 None
 0.85A 1mj2C-4p7wA:
undetectable		 1mj2C-4p7wA:
19.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4yhj G PROTEIN-COUPLED
RECEPTOR KINASE 4

(Homo sapiens) 		PF00069
(Pkinase)
PF00615
(RGS) 		5 ARG A 108
LEU A 118
ALA A 150
HIS A 151
LEU A  84
 None
 1.17A 1mj2C-4yhjA:
undetectable		 1mj2C-4yhjA:
10.48
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.
5b8h TYPE III
PANTOTHENATE KINASE

(Burkholderia
cenocepacia) 		PF03309
(Pan_kinase) 		5 GLU A 134
LEU A 110
ALA A 113
HIS A 243
LEU A 246
 None
 1.31A 1mj2C-5b8hA:
undetectable		 1mj2C-5b8hA:
14.83
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.
5h2t TREHALOSE SYNTHASE

(Thermomonospora
curvata) 		no annotation 5 GLU A 246
ARG A 249
ARG A 204
LEU A 200
GLU A 197
 None
 1.36A 1mj2C-5h2tA:
undetectable		 1mj2C-5h2tA:
11.02
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.
5l44 K-26 DIPEPTIDYL
CARBOXYPEPTIDASE

(Astrosporangium
hypotensionis) 		PF01432
(Peptidase_M3) 		5 GLU A 133
LEU A 137
GLU A  69
ALA A  66
LEU A 429
 None
 1.18A 1mj2C-5l44A:
undetectable		 1mj2C-5l44A:
9.26
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.
5nzg UDP-GLUCOSE
PYROPHOSPHORYLASE

(Leishmania
major) 		no annotation 5 GLU A 284
LEU A 282
ALA A 359
LEU A 330
PRO A 331
 UPG  A 601 (-2.7A)
UPG  A 601 ( 4.7A)
None
None
EDO  A 608 ( 4.2A)
 1.29A 1mj2C-5nzgA:
undetectable		 1mj2C-5nzgA:
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.
5uoh CARBOXYLESTERASE A

(Mycobacterium
tuberculosis) 		PF00561
(Abhydrolase_1) 		5 GLU A 408
ARG A 411
LEU A 265
GLU A 262
ALA A 263
 None
 1.38A 1mj2C-5uohA:
undetectable		 1mj2C-5uohA:
11.37
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.
6c9m N-ALPHA-ACETYLTRANSF
ERASE 15, NATA
AUXILIARY SUBUNIT

(Homo sapiens) 		no annotation 5 LEU A  13
GLU A  10
HIS A  45
LEU A   6
PRO A   7
 None
 1.46A 1mj2C-6c9mA:
undetectable		 1mj2C-6c9mA:
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.
1de6 L-RHAMNOSE ISOMERASE

(Escherichia
coli) 		PF06134
(RhaA) 		4 HIS A 228
ALA A 178
PHE A 180
GLY A 181
 None
 1.32A 1mj2D-1de6A:
undetectable		 1mj2D-1de6A:
13.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1eg7 FORMYLTETRAHYDROFOLA
TE SYNTHETASE

(Moorella
thermoacetica) 		PF01268
(FTHFS) 		4 HIS A1280
ALA A1279
PHE A1275
GLY A1281
 None
 1.37A 1mj2D-1eg7A:
undetectable		 1mj2D-1eg7A:
11.70
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.
1gz7 LIPASE 2

(Diutina rugosa) 		PF00135
(COesterase) 		4 HIS A 180
ALA A 177
PHE A  38
GLY A 175
 GOL  A1538 (-3.9A)
None
None
None
 1.30A 1mj2D-1gz7A:
undetectable		 1mj2D-1gz7A:
10.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1hw2 FATTY ACID
METABOLISM REGULATOR
PROTEIN

(Escherichia
coli) 		PF00392
(GntR)
PF07840
(FadR_C) 		4 HIS A 120
ALA A 155
PHE A 154
GLY A 157
 None
 1.14A 1mj2D-1hw2A:
undetectable		 1mj2D-1hw2A:
22.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ii2 PHOSPHOENOLPYRUVATE
CARBOXYKINASE

(Trypanosoma
cruzi) 		PF01293
(PEPCK_ATP) 		4 HIS A 205
ALA A 206
PHE A 219
GLY A 221
 None
 1.39A 1mj2D-1ii2A:
undetectable		 1mj2D-1ii2A:
11.71
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.
1j3n 3-OXOACYL-(ACYL-CARR
IER PROTEIN)
SYNTHASE II

(Thermus
thermophilus) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		4 HIS A 399
ALA A 395
PHE A 396
GLY A 397
 None
 1.40A 1mj2D-1j3nA:
undetectable		 1mj2D-1j3nA:
15.04
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.
1khd ANTHRANILATE
PHOSPHORIBOSYLTRANSF
ERASE

(Pectobacterium
carotovorum) 		PF00591
(Glycos_transf_3)
PF02885
(Glycos_trans_3N) 		4 HIS A  32
ALA A  71
PHE A  35
GLY A  67
 None
 1.35A 1mj2D-1khdA:
undetectable		 1mj2D-1khdA:
15.36
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.
1lns X-PROLYL DIPEPTIDYL
AMINOPEPTIDASE

(Lactococcus
lactis) 		PF02129
(Peptidase_S15)
PF08530
(PepX_C)
PF09168
(PepX_N) 		4 HIS A 464
ALA A 476
PHE A 479
GLY A 373
 None
 1.31A 1mj2D-1lnsA:
undetectable		 1mj2D-1lnsA:
9.38
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.
1lwd ISOCITRATE
DEHYDROGENASE

(Sus scrofa) 		PF00180
(Iso_dh) 		4 HIS A 194
ALA A 193
PHE A 192
GLY A 191
 None
 1.24A 1mj2D-1lwdA:
undetectable		 1mj2D-1lwdA:
14.09
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1mjl METHIONINE REPRESSOR
PROTEIN METJ

(Escherichia
coli) 		PF01340
(MetJ) 		4 HIS A  63
ALA A  64
PHE A  65
GLY A  67
 SAM  A 200 ( 2.9A)
SAM  A 200 (-4.0A)
SAM  A 200 (-3.8A)
SAM  A 200 ( 4.1A)
 0.25A 1mj2D-1mjlA:
15.5		 1mj2D-1mjlA:
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.
1s2n EXTRACELLULAR
SUBTILISIN-LIKE
SERINE PROTEINASE

(Vibrio sp.
PA-44) 		PF00082
(Peptidase_S8) 		4 HIS A 225
ALA A 199
PHE A 198
GLY A 201
 None
 1.22A 1mj2D-1s2nA:
undetectable		 1mj2D-1s2nA:
12.81
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.
1suw PROBABLE INORGANIC
POLYPHOSPHATE/ATP-NA
D KINASE

(Archaeoglobus
fulgidus) 		PF01513
(NAD_kinase) 		4 HIS A  78
ALA A  79
PHE A  84
GLY A  67
 None
 1.39A 1mj2D-1suwA:
undetectable		 1mj2D-1suwA:
18.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1szn ALPHA-GALACTOSIDASE

(Trichoderma
reesei) 		PF16499
(Melibiase_2) 		4 HIS A 196
ALA A 122
PHE A 121
GLY A 125
 None
 1.23A 1mj2D-1sznA:
undetectable		 1mj2D-1sznA:
13.12
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.
1vqz LIPOATE-PROTEIN
LIGASE, PUTATIVE

(Streptococcus
pneumoniae) 		PF03099
(BPL_LplA_LipB)
PF10437
(Lip_prot_lig_C) 		4 HIS A 146
ALA A 135
PHE A  98
GLY A 147
 EDO  A 410 (-3.8A)
EDO  A 414 (-3.9A)
None
EDO  A 409 (-3.6A)
 1.41A 1mj2D-1vqzA:
undetectable		 1mj2D-1vqzA:
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.
1wha KIAA0147 PROTEIN

(Homo sapiens) 		PF00595
(PDZ) 		4 HIS A  76
ALA A  25
PHE A  41
GLY A  27
 HIS  A  76 ( 1.0A)
ALA  A  25 ( 0.0A)
PHE  A  41 ( 1.3A)
GLY  A  27 ( 0.0A)
 1.20A 1mj2D-1whaA:
undetectable		 1mj2D-1whaA:
23.28
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.
1yq2 BETA-GALACTOSIDASE

(Arthrobacter
sp. C2-2) 		PF02836
(Glyco_hydro_2_C)
PF02837
(Glyco_hydro_2_N)
PF02929
(Bgal_small_N)
PF16353
(DUF4981) 		4 HIS A 992
ALA A1008
PHE A1007
GLY A 993
 None
 1.32A 1mj2D-1yq2A:
undetectable		 1mj2D-1yq2A:
6.94
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.
1z0u PROBABLE INORGANIC
POLYPHOSPHATE/ATP-NA
D KINASE

(Archaeoglobus
fulgidus) 		PF01513
(NAD_kinase) 		4 HIS A  78
ALA A  79
PHE A  84
GLY A  67
 None
 1.41A 1mj2D-1z0uA:
undetectable		 1mj2D-1z0uA:
17.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1zj9 PROBABLE
FERREDOXIN-DEPENDENT
NITRITE REDUCTASE
NIRA

(Mycobacterium
tuberculosis) 		PF01077
(NIR_SIR)
PF03460
(NIR_SIR_ferr) 		4 HIS A 500
ALA A 543
PHE A 542
GLY A 499
 None
 1.12A 1mj2D-1zj9A:
undetectable		 1mj2D-1zj9A:
10.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2a19 EUKARYOTIC
TRANSLATION
INITIATION FACTOR 2
ALPHA SUBUNIT

(Saccharomyces
cerevisiae) 		PF00575
(S1)
PF07541
(EIF_2_alpha) 		4 HIS A 139
ALA A 140
PHE A 137
GLY A 138
 None
 1.28A 1mj2D-2a19A:
undetectable		 1mj2D-2a19A:
22.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2av9 THIOESTERASE

(Pseudomonas
aeruginosa) 		PF03061
(4HBT) 		4 HIS A  30
ALA A  77
PHE A  78
GLY A  29
 None
 1.16A 1mj2D-2av9A:
undetectable		 1mj2D-2av9A:
19.05
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.
2cg5 L-AMINOADIPATE-SEMIA
LDEHYDE
DEHYDROGENASE-PHOSPH
OPANTETHEINYL
TRANSFERASE

(Homo sapiens) 		PF01648
(ACPS) 		4 HIS A 121
ALA A  69
PHE A  31
GLY A  73
 COA  A1300 (-3.6A)
None
None
None
 1.16A 1mj2D-2cg5A:
undetectable		 1mj2D-2cg5A:
16.54
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.
2dyq AMYLOID BETA A4
PRECURSOR
PROTEIN-BINDING
FAMILY B MEMBER 3

(Homo sapiens) 		no annotation 4 HIS A 395
ALA A 396
PHE A 374
GLY A 398
 None
 1.20A 1mj2D-2dyqA:
undetectable		 1mj2D-2dyqA:
22.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2i1n DISCS, LARGE HOMOLOG
3

(Homo sapiens) 		PF00595
(PDZ) 		4 HIS A 196
ALA A 146
PHE A 161
GLY A 148
 None
 1.28A 1mj2D-2i1nA:
undetectable		 1mj2D-2i1nA:
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.
2jii SERINE/THREONINE-PRO
TEIN KINASE VRK3
MOLECULE: VACCINIA
RELATED KINASE 3

(Homo sapiens) 		PF00069
(Pkinase) 		4 HIS A 304
ALA A 330
PHE A 331
GLY A 305
 None
 1.37A 1mj2D-2jiiA:
undetectable		 1mj2D-2jiiA:
13.71
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.
2w4f PROTEIN LAP4

(Homo sapiens) 		PF00595
(PDZ) 		4 HIS A 793
ALA A 743
PHE A 759
GLY A 745
 EDO  A1821 ( 4.4A)
None
None
None
 1.19A 1mj2D-2w4fA:
undetectable		 1mj2D-2w4fA:
21.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2wl7 DISKS LARGE HOMOLOG
2

(Mus musculus) 		PF00595
(PDZ) 		4 HIS A 165
ALA A 115
PHE A 130
GLY A 117
 None
 1.33A 1mj2D-2wl7A:
undetectable		 1mj2D-2wl7A:
20.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2xpi ANAPHASE-PROMOTING
COMPLEX SUBUNIT CUT9

(Schizosaccharomyces
pombe) 		PF12895
(ANAPC3)
PF13181
(TPR_8)
PF13424
(TPR_12) 		4 HIS A 415
ALA A 414
PHE A 413
GLY A 412
 None
 1.05A 1mj2D-2xpiA:
undetectable		 1mj2D-2xpiA:
10.63
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.
2xpi ANAPHASE-PROMOTING
COMPLEX SUBUNIT CUT9

(Schizosaccharomyces
pombe) 		PF12895
(ANAPC3)
PF13181
(TPR_8)
PF13424
(TPR_12) 		4 HIS A 415
ALA A 414
PHE A 417
GLY A 412
 None
 1.35A 1mj2D-2xpiA:
undetectable		 1mj2D-2xpiA:
10.63
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.
2ypj ENDOGLUCANASE CEL5A

([Eubacterium]
cellulosolvens) 		no annotation 4 HIS A 596
ALA A 597
PHE A 599
GLY A 696
 None
 1.32A 1mj2D-2ypjA:
undetectable		 1mj2D-2ypjA:
17.50
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.
2zj8 PUTATIVE SKI2-TYPE
HELICASE

(Pyrococcus
furiosus) 		PF00270
(DEAD)
PF00271
(Helicase_C)
PF14520
(HHH_5) 		4 HIS A 517
ALA A 574
PHE A 516
GLY A 514
 None
 1.34A 1mj2D-2zj8A:
undetectable		 1mj2D-2zj8A:
10.03
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.
2zsi PROBABLE GIBBERELLIN
RECEPTOR GID1L1

(Arabidopsis
thaliana) 		PF07859
(Abhydrolase_3) 		4 HIS A 119
ALA A 118
PHE A 117
GLY A 115
 None
None
None
GA4  A 345 (-3.1A)
 1.17A 1mj2D-2zsiA:
undetectable		 1mj2D-2zsiA:
13.84
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.
3a0h PHOTOSYSTEM II CORE
LIGHT HARVESTING
PROTEIN

(Thermosynechococcus
vulcanus) 		PF00421
(PSII) 		4 HIS B 216
ALA B 212
PHE B 144
GLY B 140
 None
 1.25A 1mj2D-3a0hB:
undetectable		 1mj2D-3a0hB:
11.55
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.
3a9i HOMOCITRATE SYNTHASE

(Thermus
thermophilus) 		PF00682
(HMGL-like) 		4 HIS A 195
ALA A 164
PHE A 140
GLY A 196
 LYS  A 378 ( 3.4A)
LYS  A 378 ( 3.9A)
None
None
 1.30A 1mj2D-3a9iA:
undetectable		 1mj2D-3a9iA:
18.30
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.
3bjr PUTATIVE
CARBOXYLESTERASE

(Lactobacillus
plantarum) 		PF07859
(Abhydrolase_3) 		4 HIS A  20
ALA A  58
PHE A  57
GLY A  61
 None
 0.85A 1mj2D-3bjrA:
undetectable		 1mj2D-3bjrA:
16.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3cv2 MALATE SYNTHASE A

(Escherichia
coli) 		PF01274
(Malate_synthase) 		4 HIS A 361
ALA A 326
PHE A 325
GLY A 363
 None
 1.37A 1mj2D-3cv2A:
undetectable		 1mj2D-3cv2A:
12.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3e03 SHORT CHAIN
DEHYDROGENASE

(Xanthomonas
campestris) 		PF13561
(adh_short_C2) 		4 HIS A 237
ALA A 180
PHE A 183
GLY A 184
 None
 1.39A 1mj2D-3e03A:
undetectable		 1mj2D-3e03A:
17.15
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.
3es1 CUPIN 2, CONSERVED
BARREL DOMAIN
PROTEIN

(Novosphingobium
aromaticivorans) 		PF07883
(Cupin_2) 		4 HIS A  20
ALA A  26
PHE A  28
GLY A  19
 None
 1.29A 1mj2D-3es1A:
undetectable		 1mj2D-3es1A:
21.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3f7m ALKALINE SERINE
PROTEASE VER112

(Lecanicillium
psalliotae) 		PF00082
(Peptidase_S8) 		4 HIS A 333
ALA A 307
PHE A 306
GLY A 309
 None
 1.27A 1mj2D-3f7mA:
undetectable		 1mj2D-3f7mA:
16.85
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.
3f7o SERINE PROTEASE

(Purpureocillium
lilacinum) 		PF00082
(Peptidase_S8) 		4 HIS A 232
ALA A 206
PHE A 205
GLY A 208
 None
 1.23A 1mj2D-3f7oA:
undetectable		 1mj2D-3f7oA:
16.00
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.
3gcw PROPROTEIN
CONVERTASE
SUBTILISIN/KEXIN
TYPE 9

(Homo sapiens) 		PF00082
(Peptidase_S8) 		4 HIS A 391
ALA A 363
PHE A 362
GLY A 365
 None
 1.26A 1mj2D-3gcwA:
undetectable		 1mj2D-3gcwA:
12.10
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.
3hbc CHOLOYLGLYCINE
HYDROLASE

(Bacteroides
thetaiotaomicron) 		PF02275
(CBAH) 		4 HIS A  66
ALA A 120
PHE A 149
GLY A  65
 GOL  A   5 (-4.7A)
None
None
None
 1.33A 1mj2D-3hbcA:
undetectable		 1mj2D-3hbcA:
17.94
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.
3hl0 MALEYLACETATE
REDUCTASE

(Agrobacterium
fabrum) 		PF00465
(Fe-ADH) 		4 HIS A 263
ALA A 344
PHE A 345
GLY A 347
 None
 1.01A 1mj2D-3hl0A:
undetectable		 1mj2D-3hl0A:
15.52
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.
3ife PEPTIDASE T

(Bacillus
anthracis) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		4 HIS A 165
ALA A 403
PHE A 406
GLY A 166
 None
 1.26A 1mj2D-3ifeA:
undetectable		 1mj2D-3ifeA:
14.39
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.
3ii7 KELCH-LIKE PROTEIN 7

(Homo sapiens) 		PF01344
(Kelch_1) 		4 HIS A 474
ALA A 485
PHE A 484
GLY A 475
 None
 1.36A 1mj2D-3ii7A:
undetectable		 1mj2D-3ii7A:
15.81
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.
3jb9 PRE-MRNA-SPLICING
FACTOR CWF7

(Schizosaccharomyces
pombe) 		PF01423
(LSM) 		4 HIS i 115
ALA i 119
PHE i 120
GLY i 116
 None
 1.33A 1mj2D-3jb9i:
undetectable		 1mj2D-3jb9i:
20.86
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.
3ob8 BETA-GALACTOSIDASE

(Kluyveromyces
lactis) 		PF00703
(Glyco_hydro_2)
PF02836
(Glyco_hydro_2_C)
PF02837
(Glyco_hydro_2_N)
PF02929
(Bgal_small_N) 		4 HIS A  72
ALA A 364
PHE A 361
GLY A 362
 None
 1.36A 1mj2D-3ob8A:
undetectable		 1mj2D-3ob8A:
7.72
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.
3qh4 ESTERASE LIPW

(Mycobacterium
marinum) 		PF07859
(Abhydrolase_3) 		4 HIS A 305
ALA A 301
PHE A 300
GLY A 304
 None
 1.22A 1mj2D-3qh4A:
undetectable		 1mj2D-3qh4A:
13.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ubl GLUTATHIONE
TRANSFERASE

(Leptospira
interrogans) 		PF13417
(GST_N_3) 		4 HIS A 159
ALA A 158
PHE A 157
GLY A 156
 None
 1.24A 1mj2D-3ublA:
undetectable		 1mj2D-3ublA:
17.81
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.
3usc HYDROGENASE-1 LARGE
CHAIN

(Escherichia
coli) 		PF00374
(NiFeSe_Hases) 		4 HIS L 205
ALA L 204
PHE L 203
GLY L 202
 None
 1.21A 1mj2D-3uscL:
undetectable		 1mj2D-3uscL:
10.00
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.
3zdr ALCOHOL
DEHYDROGENASE DOMAIN
OF THE BIFUNCTIONAL
ACETALDEHYDE
DEHYDROGENASE

(Parageobacillus
thermoglucosidasius) 		PF00465
(Fe-ADH) 		4 HIS A 754
ALA A 865
PHE A 866
GLY A 868
 None
 0.89A 1mj2D-3zdrA:
undetectable		 1mj2D-3zdrA:
12.21
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.
4aq2 HOMOGENTISATE
1,2-DIOXYGENASE

(Pseudomonas
putida) 		PF04209
(HgmA) 		4 HIS A 265
ALA A  20
PHE A  19
GLY A 266
 None
 1.20A 1mj2D-4aq2A:
undetectable		 1mj2D-4aq2A:
14.67
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.
4c6o CAD PROTEIN

(Homo sapiens) 		PF01979
(Amidohydro_1) 		4 HIS A1687
ALA A1688
PHE A1704
GLY A1706
 None
FMT  A2824 ( 3.6A)
None
None
 1.23A 1mj2D-4c6oA:
undetectable		 1mj2D-4c6oA:
13.21
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.
4dzt AQUALYSIN-1

(Thermus
aquaticus) 		PF00082
(Peptidase_S8) 		4 HIS A 227
ALA A 199
PHE A 198
GLY A 201
 None
 1.33A 1mj2D-4dztA:
undetectable		 1mj2D-4dztA:
14.86
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.
4hfw 6-26 FAB HEAVY CHAIN

(Homo sapiens) 		no annotation 4 HIS H  35
ALA H  97
PHE H 109
GLY H  99
 None
 1.27A 1mj2D-4hfwH:
undetectable		 1mj2D-4hfwH:
15.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4hx0 PUTATIVE
NUCLEOTIDYLTRANSFERA
SE TM1012

(Thermotoga
maritima) 		no annotation 4 HIS A  -4
ALA A  33
PHE A  32
GLY A  36
 NA  A 202 (-3.8A)
NA  A 202 (-3.9A)
None
NA  A 202 ( 3.9A)
 1.18A 1mj2D-4hx0A:
undetectable		 1mj2D-4hx0A:
22.63
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.
4jmj RNA/RNP
COMPLEX-1-INTERACTIN
G PHOSPHATASE

(Homo sapiens) 		PF00782
(DSPc) 		4 HIS A 105
ALA A 106
PHE A 110
GLY A 109
 None
 1.23A 1mj2D-4jmjA:
undetectable		 1mj2D-4jmjA:
21.51
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.
4kws D-MANNONATE
DEHYDRATASE

(Chromohalobacter
salexigens) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		4 HIS A 330
ALA A 367
PHE A 365
GLY A 326
 None
 1.16A 1mj2D-4kwsA:
undetectable		 1mj2D-4kwsA:
14.82
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.
4mda MARINER MOS1
TRANSPOSASE

(Drosophila
mauritiana) 		PF01359
(Transposase_1) 		4 HIS A 293
ALA A 289
PHE A 288
GLY A 292
 None
 1.18A 1mj2D-4mdaA:
undetectable		 1mj2D-4mdaA:
17.94
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.
4og1 ENOYL-COA
HYDRATASE/ISOMERASE

(Novosphingobium
aromaticivorans) 		PF00378
(ECH_1) 		4 HIS A   7
ALA A  35
PHE A  37
GLY A  39
 None
 1.37A 1mj2D-4og1A:
undetectable		 1mj2D-4og1A:
14.09
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.
4oua LATENT FORM OF PPO4
TYROSINASE

(Agaricus
bisporus) 		PF00264
(Tyrosinase) 		4 HIS B  57
ALA B 270
PHE B 272
GLY B  58
 CU1  B 601 (-3.1A)
None
None
NA  B 603 (-4.5A)
 1.33A 1mj2D-4ouaB:
undetectable		 1mj2D-4ouaB:
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.
4oua PROTEOLYTICALLY
ACTIVATED FORM OF
PPO4 TYROSINASE

(Agaricus
bisporus) 		PF00264
(Tyrosinase) 		4 HIS A  57
ALA A 270
PHE A 272
GLY A  58
 CU1  A 401 (-3.2A)
None
None
NA  A 403 (-4.4A)
 1.35A 1mj2D-4ouaA:
undetectable		 1mj2D-4ouaA:
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.
4ov6 PROPROTEIN
CONVERTASE
SUBTILISIN/KEXIN
TYPE 9

(Homo sapiens) 		PF00082
(Peptidase_S8) 		4 HIS B 391
ALA B 363
PHE B 362
GLY B 365
 None
 1.21A 1mj2D-4ov6B:
undetectable		 1mj2D-4ov6B:
17.06
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.
4ovj EXTRACELLULAR
SOLUTE-BINDING
PROTEIN FAMILY 1

(Alicyclobacillus
acidocaldarius) 		PF13416
(SBP_bac_8) 		4 HIS A 177
ALA A 172
PHE A 171
GLY A 175
 None
 1.40A 1mj2D-4ovjA:
undetectable		 1mj2D-4ovjA:
12.50
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.
4p79 CLAUDIN-15

(Mus musculus) 		PF00822
(PMP22_Claudin) 		4 HIS A 124
ALA A 120
PHE A 180
GLY A 176
 None
 1.35A 1mj2D-4p79A:
undetectable		 1mj2D-4p79A:
18.65
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.
4pe5 GLUTAMATE RECEPTOR
IONOTROPIC, NMDA 2B

(Rattus
norvegicus) 		PF00060
(Lig_chan)
PF01094
(ANF_receptor)
PF10613
(Lig_chan-Glu_bd) 		4 HIS B 127
ALA B 100
PHE B  99
GLY B 128
 None
 1.17A 1mj2D-4pe5B:
undetectable		 1mj2D-4pe5B:
7.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4q2c CRISPR-ASSOCIATED
HELICASE CAS3

(Thermobaculum
terrenum) 		PF00271
(Helicase_C) 		4 HIS A  98
ALA A  95
PHE A  94
GLY A  97
 NI  A1001 (-3.4A)
None
None
None
 0.74A 1mj2D-4q2cA:
undetectable		 1mj2D-4q2cA:
8.82
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.
4qyr AT-LESS POLYKETIDE
SYNTHASE

(Streptomyces
platensis) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C)
PF16197
(KAsynt_C_assoc) 		4 HIS A2807
ALA A2966
PHE A2961
GLY A2808
 None
 1.34A 1mj2D-4qyrA:
undetectable		 1mj2D-4qyrA:
10.25
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.
4rku PHOTOSYSTEM I P700
CHLOROPHYLL A
APOPROTEIN A2

(Pisum sativum) 		PF00223
(PsaA_PsaB) 		4 HIS B 389
ALA B 388
PHE B 387
GLY B 335
 CLA  B1226 (-4.0A)
CLA  B1226 ( 4.2A)
BCR  B6010 ( 3.2A)
BCR  B6010 ( 4.3A)
 1.06A 1mj2D-4rkuB:
undetectable		 1mj2D-4rkuB:
9.84
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.
4rzc FV M6P-1 HEAVY CHAIN

(Oryctolagus
cuniculus) 		no annotation 4 HIS L  89
ALA L  34
PHE L  71
GLY L  90
 None
 1.31A 1mj2D-4rzcL:
undetectable		 1mj2D-4rzcL:
14.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4wso PROBABLE
NICOTINATE-NUCLEOTID
E
ADENYLYLTRANSFERASE

(Burkholderia
thailandensis) 		PF01467
(CTP_transf_like) 		4 HIS A 157
ALA A 156
PHE A 155
GLY A 195
 None
 1.23A 1mj2D-4wsoA:
undetectable		 1mj2D-4wsoA:
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.
4ywe PUTATIVE ALDEHYDE
DEHYDROGENASE

(Burkholderia
cenocepacia) 		PF00171
(Aldedh) 		4 HIS A 349
ALA A 348
PHE A 306
GLY A 350
 None
 1.39A 1mj2D-4yweA:
undetectable		 1mj2D-4yweA:
13.87
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.
4zdn AT-LESS POLYKETIDE
SYNTHASE

(Streptomyces
platensis) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C)
PF16197
(KAsynt_C_assoc) 		4 HIS A 823
ALA A 974
PHE A 969
GLY A 824
 None
 1.39A 1mj2D-4zdnA:
undetectable		 1mj2D-4zdnA:
9.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5a4j FORMATE--TETRAHYDROF
OLATE LIGASE

(Tepidanaerobacter
acetatoxydans) 		PF01268
(FTHFS) 		4 HIS A 279
ALA A 278
PHE A 274
GLY A 280
 None
 1.35A 1mj2D-5a4jA:
undetectable		 1mj2D-5a4jA:
12.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5a5g FORMATE--TETRAHYDROF
OLATE LIGASE

(Tepidanaerobacter
acetatoxydans) 		PF01268
(FTHFS) 		4 HIS A 278
ALA A 277
PHE A 273
GLY A 279
 None
 1.34A 1mj2D-5a5gA:
undetectable		 1mj2D-5a5gA:
10.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5afe ENDOGLUCANASE CEL5A

([Eubacterium]
cellulosolvens) 		no annotation 4 HIS A 596
ALA A 597
PHE A 599
GLY A 696
 None
 1.36A 1mj2D-5afeA:
undetectable		 1mj2D-5afeA:
21.68
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.
5cqr ELONGATOR COMPLEX
PROTEIN 1

(Homo sapiens) 		PF04762
(IKI3) 		4 HIS A1015
ALA A1010
PHE A1009
GLY A1013
 None
 1.41A 1mj2D-5cqrA:
undetectable		 1mj2D-5cqrA:
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.
5de0 DEFERROCHELATASE

(Vibrio cholerae) 		PF04261
(Dyp_perox) 		4 HIS A 100
ALA A 101
PHE A  15
GLY A  13
 None
 0.83A 1mj2D-5de0A:
undetectable		 1mj2D-5de0A:
16.10
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.
5et1 ESPIN

(Mus musculus) 		PF12796
(Ank_2)
PF13637
(Ank_4)
PF13857
(Ank_5) 		4 HIS A 317
ALA A 312
PHE A 314
GLY A 316
 None
 1.33A 1mj2D-5et1A:
undetectable		 1mj2D-5et1A:
12.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5g5z ABC TRANSPORTER,
SUBSTRATE-BINDING
PROTEIN

(Streptococcus
pneumoniae) 		PF01547
(SBP_bac_1) 		4 HIS A 340
ALA A 243
PHE A 242
GLY A 246
 None
 1.38A 1mj2D-5g5zA:
undetectable		 1mj2D-5g5zA:
15.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5icl LIPOATE--PROTEIN
LIGASE

(Enterococcus
faecalis) 		PF03099
(BPL_LplA_LipB)
PF10437
(Lip_prot_lig_C) 		4 HIS A 147
ALA A 146
PHE A  86
GLY A 148
 LAQ  A 401 (-3.7A)
None
None
LAQ  A 401 ( 3.8A)
 1.26A 1mj2D-5iclA:
undetectable		 1mj2D-5iclA:
12.78
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.
5iuf BIFUNCTIONAL
OLIGORIBONUCLEASE
AND PAP PHOSPHATASE
NRNA

(Bacillus
subtilis) 		PF01368
(DHH)
PF02272
(DHHA1) 		4 HIS A 284
ALA A 287
PHE A 265
GLY A 283
 A3P  A 402 (-3.7A)
A3P  A 401 ( 4.7A)
None
A3P  A 401 (-3.4A)
 1.36A 1mj2D-5iufA:
undetectable		 1mj2D-5iufA:
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.
5jor FAB14.22 HEAVY CHAIN

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		4 HIS B  82
ALA B  67
PHE B  63
GLY B  65
 None
 1.25A 1mj2D-5jorB:
undetectable		 1mj2D-5jorB:
16.94
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.
5ns8 -

(-) 		no annotation 4 HIS A 173
ALA A 169
PHE A 166
GLY A 172
 None
 1.33A 1mj2D-5ns8A:
undetectable		 1mj2D-5ns8A:
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.
5opq 3,6-ANHYDRO-D-GALACT
OSIDASE

(Zobellia
galactanivorans) 		no annotation 4 HIS A 518
ALA A 490
PHE A 489
GLY A 519
 None
 0.87A 1mj2D-5opqA:
undetectable		 1mj2D-5opqA:
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.
5ouo PERFORIN-LIKE
PROTEIN 1

(Toxoplasma
gondii) 		no annotation 4 HIS A1061
ALA A 993
PHE A1058
GLY A 991
 None
 1.12A 1mj2D-5ouoA:
undetectable		 1mj2D-5ouoA:
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.
5oy0 PHOTOSYSTEM I P700
CHLOROPHYLL A
APOPROTEIN A2

(Synechocystis
sp. PCC 6803) 		no annotation 4 HIS b 387
ALA b 386
PHE b 385
GLY b 333
 CLA  b1832 (-3.9A)
CLA  b1832 ( 3.9A)
BCR  b1848 ( 3.3A)
BCR  b1848 ( 4.4A)
 1.11A 1mj2D-5oy0b:
undetectable		 1mj2D-5oy0b:
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.
5tnx ALCOHOL
DEHYDROGENASE
ZINC-BINDING DOMAIN
PROTEIN

(Burkholderia
ambifaria) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		4 HIS A 139
ALA A  64
PHE A 142
GLY A 121
 None
 1.24A 1mj2D-5tnxA:
undetectable		 1mj2D-5tnxA:
12.68
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.
5tpz GLUTAMATE RECEPTOR
IONOTROPIC, NMDA 2B

(Rattus
norvegicus) 		PF01094
(ANF_receptor) 		4 HIS D 127
ALA D 100
PHE D  99
GLY D 128
 None
 1.33A 1mj2D-5tpzD:
undetectable		 1mj2D-5tpzD:
16.52
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.
5uzu UNCHARACTERISED
PROTEIN

(Staphylococcus
aureus) 		no annotation 4 HIS B  82
ALA B  77
PHE B  76
GLY B  80
 None
 1.09A 1mj2D-5uzuB:
undetectable		 1mj2D-5uzuB:
19.81
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.
5vlh PROPROTEIN
CONVERTASE
SUBTILISIN/KEXIN
TYPE 9

(Homo sapiens) 		PF00082
(Peptidase_S8)
PF05922
(Inhibitor_I9) 		4 HIS A 391
ALA A 363
PHE A 362
GLY A 365
 None
 1.28A 1mj2D-5vlhA:
undetectable		 1mj2D-5vlhA:
14.22
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.
5vwk PROTEIN SCRIBBLE
HOMOLOG

(Homo sapiens) 		no annotation 4 HIS A 793
ALA A 743
PHE A 759
GLY A 745
 None
 1.18A 1mj2D-5vwkA:
undetectable		 1mj2D-5vwkA:
22.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5wou PROTEIN LAP4

(Drosophila
melanogaster) 		no annotation 4 HIS A  71
ALA A  21
PHE A  37
GLY A  23
 EDO  A 105 (-4.1A)
None
None
EDO  A 103 (-3.7A)
 1.21A 1mj2D-5wouA:
undetectable		 1mj2D-5wouA:
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.
5wsl KERATINASE

(Meiothermus
taiwanensis) 		no annotation 4 HIS A 229
ALA A 201
PHE A 200
GLY A 203
 None
 1.24A 1mj2D-5wslA:
undetectable		 1mj2D-5wslA:
15.72
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.
5x03 HTH-TYPE
TRANSCRIPTIONAL
REGULATORY PROTEIN
GABR

(Bacillus
subtilis) 		PF00155
(Aminotran_1_2) 		4 HIS A 417
ALA A 467
PHE A 465
GLY A 470
 None
 1.31A 1mj2D-5x03A:
undetectable		 1mj2D-5x03A:
15.82
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.
5x33 LTB4
RECEPTOR,LYSOZYME,LT
B4 RECEPTOR

(Cavia
porcellus;
Escherichia
virus T4) 		no annotation 4 HIS A 240
ALA A 188
PHE A 186
GLY A 191
 None
 1.37A 1mj2D-5x33A:
undetectable		 1mj2D-5x33A:
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.
6azp STAPHYLOCOCCAL
PEROXIDASE INHIBITOR

(Staphylococcus
aureus) 		no annotation 4 HIS B  82
ALA B  77
PHE B  76
GLY B  80
 None
 1.04A 1mj2D-6azpB:
undetectable		 1mj2D-6azpB:
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.
6c2h CYSTATHIONINE
BETA-SYNTHASE

(Saccharomyces
cerevisiae) 		no annotation 4 HIS A 167
ALA A 166
PHE A 169
GLY A 203
 None
PGE  A 409 ( 4.3A)
PGE  A 409 (-4.2A)
None
 1.06A 1mj2D-6c2hA:
undetectable		 1mj2D-6c2hA:
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.
6c5c 3-DEHYDROQUINATE
SYNTHASE

(Candida
albicans) 		no annotation 4 HIS A 165
ALA A 122
PHE A 125
GLY A 128
 None
 1.33A 1mj2D-6c5cA:
undetectable		 1mj2D-6c5cA:
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.
6d7a PERFORIN-LIKE
PROTEIN 1

(Toxoplasma
gondii) 		no annotation 4 HIS A1074
ALA A1006
PHE A1071
GLY A1004
 None
 1.21A 1mj2D-6d7aA:
undetectable		 1mj2D-6d7aA:
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.
6fos PHOTOSYSTEM I P700
CHLOROPHYLL A
APOPROTEIN A2

(Cyanidioschyzon
merolae) 		no annotation 4 HIS B 387
ALA B 386
PHE B 385
GLY B 333
 CLA  B1226 (-4.1A)
CLA  B1226 ( 4.4A)
BCR  B4008 (-4.8A)
BCR  B4008 ( 4.6A)
 1.39A 1mj2D-6fosB:
undetectable		 1mj2D-6fosB:
undetectable