SIMILAR PATTERNS OF AMINO ACIDS FOR 2NPN_A_SAMA4633_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.
1cp9 PENICILLIN G AMIDASE

(Providencia
rettgeri) 		PF01804
(Penicil_amidase) 		5 GLY B 360
LEU B 355
THR B 358
ALA B 357
THR B 426
 None
 1.09A 2npnA-1cp9B:
undetectable		 2npnA-1cp9B:
18.81
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.
1e1k ADRENODOXIN
REDUCTASE

(Bos taurus) 		PF07992
(Pyr_redox_2) 		5 THR A  21
GLY A  18
TYR A  37
LEU A  91
LEU A 390
 None
 1.24A 2npnA-1e1kA:
undetectable		 2npnA-1e1kA:
22.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1g71 DNA PRIMASE

(Pyrococcus
furiosus) 		PF01896
(DNA_primase_S) 		5 THR A 284
GLY A 281
TYR A 278
LEU A 124
THR A 128
 None
 1.27A 2npnA-1g71A:
undetectable		 2npnA-1g71A:
23.06
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.
1g8p MAGNESIUM-CHELATASE
38 KDA SUBUNIT

(Rhodobacter
capsulatus) 		PF01078
(Mg_chelatase) 		5 THR A 293
GLY A 210
ALA A 322
LEU A  34
LEU A 294
 None
 1.27A 2npnA-1g8pA:
undetectable		 2npnA-1g8pA:
23.80
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.
1i1q ANTHRANILATE
SYNTHASE COMPONENT I

(Salmonella
enterica) 		PF00425
(Chorismate_bind)
PF04715
(Anth_synt_I_N) 		5 THR A 464
GLY A 454
TYR A 173
LEU A 154
LEU A 312
 None
TRP  A1001 ( 3.8A)
None
None
None
 1.06A 2npnA-1i1qA:
undetectable		 2npnA-1i1qA:
21.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1j3n 3-OXOACYL-(ACYL-CARR
IER PROTEIN)
SYNTHASE II

(Thermus
thermophilus) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		5 GLY A 341
LEU A 339
ALA A 345
LEU A  12
LEU A 168
 None
 1.20A 2npnA-1j3nA:
undetectable		 2npnA-1j3nA:
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.
1l5j ACONITATE HYDRATASE
2

(Escherichia
coli) 		PF00330
(Aconitase)
PF06434
(Aconitase_2_N)
PF11791
(Aconitase_B_N) 		5 THR A 733
GLY A 818
ALA A 815
LEU A 810
LEU A 735
 None
 0.98A 2npnA-1l5jA:
undetectable		 2npnA-1l5jA:
15.63
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.
1r5n EUKARYOTIC PEPTIDE
CHAIN RELEASE FACTOR
GTP-BINDING SUBUNIT

(Schizosaccharomyces
pombe) 		PF00009
(GTP_EFTU)
PF03143
(GTP_EFTU_D3) 		5 THR A 585
GLY A 544
THR A 543
ALA A 474
LEU A 532
 None
 1.27A 2npnA-1r5nA:
2.5		 2npnA-1r5nA:
20.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1rr9 ATP-DEPENDENT
PROTEASE LA

(Escherichia
coli) 		PF05362
(Lon_C) 		5 GLY A 681
TYR A 626
ALA A 640
LEU A 624
LEU A 709
 None
 1.08A 2npnA-1rr9A:
undetectable		 2npnA-1rr9A:
22.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1taq TAQ DNA POLYMERASE

(Thermus
aquaticus) 		PF00476
(DNA_pol_A)
PF01367
(5_3_exonuc)
PF02739
(5_3_exonuc_N)
PF09281
(Taq-exonuc) 		5 GLY A 198
THR A 203
ALA A 204
LEU A 208
THR A 186
 None
 1.24A 2npnA-1taqA:
undetectable		 2npnA-1taqA:
15.17
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.
1wrm DUAL SPECIFICITY
PHOSPHATASE 22

(Homo sapiens) 		PF00782
(DSPc) 		5 THR A 107
LEU A 150
TYR A 154
THR A 105
LEU A  79
 None
 0.96A 2npnA-1wrmA:
2.9		 2npnA-1wrmA:
21.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1xoc OLIGOPEPTIDE-BINDING
PROTEIN APPA

(Bacillus
subtilis) 		PF00496
(SBP_bac_5) 		5 LEU A  38
TYR A  39
THR A 156
ALA A 157
LEU A  34
 None
 1.24A 2npnA-1xocA:
undetectable		 2npnA-1xocA:
19.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1yln HYPOTHETICAL PROTEIN
VCA0042

(Vibrio cholerae) 		PF07238
(PilZ)
PF12945
(YcgR_2) 		5 GLY A 204
THR A 203
ALA A 186
LEU A 160
LEU A 150
 None
 1.29A 2npnA-1ylnA:
undetectable		 2npnA-1ylnA:
23.84
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.
2eta TRANSIENT RECEPTOR
POTENTIAL CATION
CHANNEL SUBFAMILY V
MEMBER 2

(Rattus
norvegicus) 		PF12796
(Ank_2) 		5 GLY A 278
LEU A 275
TYR A 271
LEU A 253
THR A 248
 None
 1.05A 2npnA-2etaA:
undetectable		 2npnA-2etaA:
22.83
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.
2f37 TRANSIENT RECEPTOR
POTENTIAL CATION
CHANNEL SUBFAMILY V
MEMBER 2

(Homo sapiens) 		PF12796
(Ank_2) 		5 GLY A 277
LEU A 274
TYR A 270
LEU A 252
THR A 247
 None
 1.08A 2npnA-2f37A:
undetectable		 2npnA-2f37A:
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.
2fj0 CARBOXYLIC ESTER
HYDROLASE

(Manduca sexta) 		PF00135
(COesterase) 		5 GLY A 224
LEU A 222
THR A 232
ALA A 231
LEU A 202
 None
 1.15A 2npnA-2fj0A:
2.6		 2npnA-2fj0A:
17.32
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.
2gah HETEROTETRAMERIC
SARCOSINE OXIDASE
GAMMA-SUBUNIT

(Stenotrophomonas
maltophilia) 		PF04268
(SoxG) 		5 GLY C 128
THR C 127
ALA C 172
LEU C 165
THR C 168
 None
 1.18A 2npnA-2gahC:
undetectable		 2npnA-2gahC:
24.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2i1y RECEPTOR-TYPE
TYROSINE-PROTEIN
PHOSPHATASE

(Homo sapiens) 		PF00102
(Y_phosphatase) 		5 THR A 884
LEU A 963
ALA A 965
LEU A 921
LEU A 888
 None
 1.30A 2npnA-2i1yA:
3.5		 2npnA-2i1yA:
22.54
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.
2i7n PANTOTHENATE KINASE
1

(Homo sapiens) 		PF03630
(Fumble) 		5 THR A 442
GLY A 445
LEU A 450
LEU A 438
THR A 521
 None
 1.19A 2npnA-2i7nA:
2.3		 2npnA-2i7nA:
19.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2i7p PANTOTHENATE KINASE
3

(Homo sapiens) 		PF03630
(Fumble) 		5 THR A 217
GLY A 220
LEU A 225
LEU A 213
THR A 296
 None
 1.20A 2npnA-2i7pA:
2.3		 2npnA-2i7pA:
19.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2j3r ZGC 92866

(Danio rerio) 		PF04051
(TRAPP) 		5 GLY B 144
THR B 143
ALA B 140
LEU B 137
THR B 168
 None
None
NO3  B1177 (-3.1A)
None
NO3  B1177 ( 3.7A)
 1.26A 2npnA-2j3rB:
undetectable		 2npnA-2j3rB:
19.25
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.
2j3w ZGC 92866

(Danio rerio) 		PF04051
(TRAPP) 		5 GLY B 144
THR B 143
ALA B 140
LEU B 137
THR B 168
 None
 1.26A 2npnA-2j3wB:
undetectable		 2npnA-2j3wB:
20.68
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.
2kbe ATP-DEPENDENT RNA
HELICASE DBP5

(Saccharomyces
cerevisiae) 		PF00270
(DEAD) 		5 GLY A 143
THR A 145
ALA A 147
LEU A 123
LEU A 150
 None
 1.15A 2npnA-2kbeA:
undetectable		 2npnA-2kbeA:
20.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2klo DNA REPLICATION
FACTOR CDT1

(Mus musculus) 		PF16679
(CDT1_C) 		5 GLY A 124
LEU A 122
THR A 126
LEU A 116
LEU A  98
 None
 1.18A 2npnA-2kloA:
undetectable		 2npnA-2kloA:
21.96
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2npn PUTATIVE COBALAMIN
SYNTHESIS RELATED
PROTEIN

(Corynebacterium
diphtheriae) 		PF00590
(TP_methylase) 		7 LEU A 114
TYR A 115
THR A 142
ALA A 143
LEU A 185
LEU A 147
THR A 243
 SAM  A4633 (-4.1A)
None
SAM  A4633 (-4.0A)
SAM  A4633 (-3.5A)
SAM  A4633 (-4.2A)
None
SAM  A4633 (-3.9A)
 1.50A 2npnA-2npnA:
39.8		 2npnA-2npnA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2npn PUTATIVE COBALAMIN
SYNTHESIS RELATED
PROTEIN

(Corynebacterium
diphtheriae) 		PF00590
(TP_methylase) 		6 THR A  11
GLY A  10
THR A 142
ALA A 143
LEU A 207
THR A 243
 SAM  A4633 (-4.4A)
None
SAM  A4633 (-4.0A)
SAM  A4633 (-3.5A)
SAM  A4633 (-3.6A)
SAM  A4633 (-3.9A)
 1.13A 2npnA-2npnA:
39.8		 2npnA-2npnA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2npn PUTATIVE COBALAMIN
SYNTHESIS RELATED
PROTEIN

(Corynebacterium
diphtheriae) 		PF00590
(TP_methylase) 		9 THR A  11
GLY A 110
LEU A 114
TYR A 115
THR A 142
ALA A 143
LEU A 185
LEU A 207
THR A 243
 SAM  A4633 (-4.4A)
SAM  A4633 (-3.5A)
SAM  A4633 (-4.1A)
None
SAM  A4633 (-4.0A)
SAM  A4633 (-3.5A)
SAM  A4633 (-4.2A)
SAM  A4633 (-3.6A)
SAM  A4633 (-3.9A)
 0.00A 2npnA-2npnA:
39.8		 2npnA-2npnA:
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.
2og7 ASPARAGINE OXYGENASE

(Streptomyces
coelicolor) 		PF02668
(TauD) 		5 GLY A 115
THR A 112
ALA A 113
LEU A 110
THR A 306
 None
 1.30A 2npnA-2og7A:
undetectable		 2npnA-2og7A:
21.61
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.
2ogj DIHYDROOROTASE

(Agrobacterium
fabrum) 		PF01979
(Amidohydro_1) 		5 THR A 362
ALA A 361
LEU A 311
LEU A 359
THR A 306
 None
 1.13A 2npnA-2ogjA:
undetectable		 2npnA-2ogjA:
22.75
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.
2ogx MOLYBDENUM STORAGE
PROTEIN SUBUNIT
ALPHA

(Azotobacter
vinelandii) 		PF00696
(AA_kinase) 		5 THR A 144
GLY A 124
LEU A 120
ALA A 146
LEU A 141
 None
 1.07A 2npnA-2ogxA:
2.5		 2npnA-2ogxA:
24.75
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.
2p88 MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME
FAMILY PROTEIN

(Bacillus cereus) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 GLY A  48
THR A  98
ALA A  99
LEU A  70
THR A  65
 None
 1.06A 2npnA-2p88A:
undetectable		 2npnA-2p88A:
23.16
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.
2pfk 6-PHOSPHOFRUCTOKINAS
E ISOZYME I

(Escherichia
coli) 		PF00365
(PFK) 		5 THR A 113
GLY A 280
LEU A 275
LEU A 122
LEU A 112
 None
 1.28A 2npnA-2pfkA:
2.5		 2npnA-2pfkA:
22.85
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.
2pnn TRANSIENT RECEPTOR
POTENTIAL CATION
CHANNEL SUBFAMILY V
MEMBER 1

(Rattus
norvegicus) 		PF12796
(Ank_2) 		5 GLY A 316
LEU A 313
TYR A 309
LEU A 291
THR A 286
 GLY  A 316 ( 0.0A)
LEU  A 313 ( 0.5A)
TYR  A 309 ( 1.3A)
LEU  A 291 ( 0.6A)
THR  A 286 ( 0.8A)
 1.03A 2npnA-2pnnA:
undetectable		 2npnA-2pnnA:
23.13
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.
2qu7 PUTATIVE
TRANSCRIPTIONAL
REGULATOR

(Staphylococcus
saprophyticus) 		PF13407
(Peripla_BP_4) 		5 LEU A 183
THR A 250
ALA A 249
LEU A 239
LEU A 255
 None
 1.25A 2npnA-2qu7A:
3.9		 2npnA-2qu7A:
22.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2veo LIPASE A

(Moesziomyces
antarcticus) 		PF03583
(LIP) 		5 THR A 123
TYR A 105
THR A 118
ALA A 119
LEU A 108
 None
 1.17A 2npnA-2veoA:
2.1		 2npnA-2veoA:
20.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2zu6 PROGRAMMED CELL
DEATH PROTEIN 4

(Homo sapiens) 		PF02847
(MA3) 		5 GLY B 270
LEU B 274
TYR B 278
ALA B 266
LEU B 301
 None
 0.89A 2npnA-2zu6B:
undetectable		 2npnA-2zu6B:
22.50
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.
3bc8 O-PHOSPHOSERYL-TRNA(
SEC) SELENIUM
TRANSFERASE

(Mus musculus) 		PF05889
(SepSecS) 		5 GLY A  45
LEU A 329
TYR A 334
LEU A 128
LEU A  35
 None
 1.08A 2npnA-3bc8A:
undetectable		 2npnA-3bc8A:
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.
3cdk SUCCINYL-COA:3-KETOA
CID-COENZYME A
TRANSFERASE SUBUNIT
B

(Bacillus
subtilis) 		PF01144
(CoA_trans) 		5 GLY B 164
THR B 163
ALA B 114
LEU B 171
LEU B 160
 None
 1.29A 2npnA-3cdkB:
undetectable		 2npnA-3cdkB:
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.
3cjy PUTATIVE
THIOESTERASE

(Novosphingobium
aromaticivorans) 		PF13622
(4HBT_3) 		5 GLY A 250
THR A 249
ALA A 248
LEU A  44
LEU A 247
 None
 1.30A 2npnA-3cjyA:
undetectable		 2npnA-3cjyA:
20.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3fed GLUTAMATE
CARBOXYPEPTIDASE III

(Homo sapiens) 		PF02225
(PA)
PF04253
(TFR_dimer)
PF04389
(Peptidase_M28) 		5 THR A  68
LEU A 551
TYR A 556
THR A 548
ALA A 375
 None
None
NAG  A1758 (-3.4A)
None
None
 1.26A 2npnA-3fedA:
undetectable		 2npnA-3fedA:
15.54
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.
3fww BIFUNCTIONAL PROTEIN
GLMU

(Yersinia pestis) 		PF00132
(Hexapep)
PF12804
(NTP_transf_3) 		5 THR A 170
GLY A 171
LEU A 102
LEU A 118
THR A 113
 None
 1.22A 2npnA-3fwwA:
undetectable		 2npnA-3fwwA:
22.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3h8f CYTOSOL
AMINOPEPTIDASE

(Pseudomonas
putida) 		PF00883
(Peptidase_M17)
PF02789
(Peptidase_M17_N) 		5 THR A  15
LEU A  74
THR A  17
ALA A 108
LEU A 112
 None
 1.27A 2npnA-3h8fA:
3.0		 2npnA-3h8fA:
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.
3hrd NICOTINATE
DEHYDROGENASE LARGE
MOLYBDOPTERIN
SUBUNIT

(Eubacterium
barkeri) 		PF01315
(Ald_Xan_dh_C)
PF02738
(Ald_Xan_dh_C2) 		5 GLY A  40
ALA A 106
LEU A 253
LEU A  37
THR A 258
 None
 1.31A 2npnA-3hrdA:
undetectable		 2npnA-3hrdA:
22.97
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.
3im7 CARDIAC CA2+ RELEASE
CHANNEL

(Mus musculus) 		PF08709
(Ins145_P3_rec) 		5 GLY A 116
THR A 161
ALA A 118
LEU A  69
LEU A  78
 None
 1.19A 2npnA-3im7A:
undetectable		 2npnA-3im7A:
20.08
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.
3iwa FAD-DEPENDENT
PYRIDINE
NUCLEOTIDE-DISULPHID
E OXIDOREDUCTASE

(Desulfovibrio
vulgaris) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		5 GLY A 292
LEU A 120
ALA A 290
LEU A 269
THR A 283
 None
 1.17A 2npnA-3iwaA:
undetectable		 2npnA-3iwaA:
21.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3k33 DEATH ON CURING
PROTEIN

(Escherichia
virus P1) 		PF02661
(Fic) 		5 THR A  62
THR A  75
ALA A  76
LEU A  59
THR A 101
 None
 1.25A 2npnA-3k33A:
undetectable		 2npnA-3k33A:
22.40
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.
3kkc TETR FAMILY
TRANSCRIPTIONAL
REGULATOR

(Streptococcus
agalactiae) 		PF00440
(TetR_N)
PF14278
(TetR_C_8) 		5 GLY A  42
TYR A  50
ALA A  39
LEU A  56
LEU A  38
 None
 1.30A 2npnA-3kkcA:
undetectable		 2npnA-3kkcA:
21.69
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.
3myv SUSD SUPERFAMILY
PROTEIN

(Bacteroides
vulgatus) 		PF07980
(SusD_RagB)
PF14322
(SusD-like_3) 		5 THR A 196
LEU A 109
ALA A 144
LEU A  49
LEU A 197
 None
 1.08A 2npnA-3myvA:
undetectable		 2npnA-3myvA:
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.
3nd0 SLL0855 PROTEIN

(Synechocystis
sp. PCC 6803) 		PF00654
(Voltage_CLC) 		5 THR A 147
GLY A 180
THR A 183
ALA A 184
LEU A 403
 None
 1.31A 2npnA-3nd0A:
undetectable		 2npnA-3nd0A:
19.73
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3nd1 PRECORRIN-6A
SYNTHASE/COBF
PROTEIN

(Rhodobacter
capsulatus) 		PF00590
(TP_methylase) 		6 LEU A 117
TYR A 118
THR A 143
ALA A 144
LEU A 187
LEU A 148
 SAH  A 300 (-3.9A)
None
ACT  A2384 (-3.9A)
SAH  A 300 (-3.3A)
SAH  A 300 (-4.6A)
None
 1.31A 2npnA-3nd1A:
27.5		 2npnA-3nd1A:
38.32
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3nd1 PRECORRIN-6A
SYNTHASE/COBF
PROTEIN

(Rhodobacter
capsulatus) 		PF00590
(TP_methylase) 		7 THR A  11
GLY A 113
LEU A 117
TYR A 118
THR A 143
ALA A 144
LEU A 187
 SAH  A 300 (-4.4A)
SAH  A 300 (-3.4A)
SAH  A 300 (-3.9A)
None
ACT  A2384 (-3.9A)
SAH  A 300 (-3.3A)
SAH  A 300 (-4.6A)
 0.44A 2npnA-3nd1A:
27.5		 2npnA-3nd1A:
38.32
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.
3nra ASPARTATE
AMINOTRANSFERASE

(Rhodobacter
sphaeroides) 		PF00155
(Aminotran_1_2) 		5 THR A 107
GLY A 262
THR A 110
ALA A 113
LEU A 116
 None
None
LLP  A 252 ( 4.2A)
None
None
 1.25A 2npnA-3nraA:
undetectable		 2npnA-3nraA:
22.03
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.
3paj NICOTINATE-NUCLEOTID
E PYROPHOSPHORYLASE,
CARBOXYLATING

(Vibrio cholerae) 		PF01729
(QRPTase_C)
PF02749
(QRPTase_N) 		5 THR A 143
LEU A 147
TYR A 136
ALA A 269
LEU A 262
 None
 1.09A 2npnA-3pajA:
undetectable		 2npnA-3pajA:
21.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3pnd THIAMINE
BIOSYNTHESIS
LIPOPROTEIN APBE

(Salmonella
enterica) 		PF02424
(ApbE) 		5 GLY A 299
TYR A 189
ALA A 109
LEU A  75
LEU A 110
 None
SO4  A 360 (-4.8A)
None
FAD  A 500 ( 4.5A)
None
 1.31A 2npnA-3pndA:
undetectable		 2npnA-3pndA:
23.85
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.
3rmt 3-PHOSPHOSHIKIMATE
1-CARBOXYVINYLTRANSF
ERASE 1

(Bacillus
halodurans) 		PF00275
(EPSP_synthase) 		5 GLY A 156
LEU A 110
THR A 109
LEU A  91
LEU A 134
 None
 1.19A 2npnA-3rmtA:
undetectable		 2npnA-3rmtA:
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.
3ss7 D-SERINE DEHYDRATASE

(Escherichia
coli) 		PF00291
(PALP) 		5 GLY X  74
LEU X  63
TYR X  62
THR X  70
LEU X 150
 None
 1.31A 2npnA-3ss7X:
1.7		 2npnA-3ss7X:
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.
3u4g NAMN:DMB
PHOSPHORIBOSYLTRANSF
ERASE

(Pyrococcus
horikoshii) 		no annotation 5 GLY A 204
THR A 148
ALA A 149
LEU A 153
THR A 228
 None
 1.26A 2npnA-3u4gA:
1.1		 2npnA-3u4gA:
23.94
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.
3v0t PERAKINE REDUCTASE

(Rauvolfia
serpentina) 		PF00248
(Aldo_ket_red) 		5 GLY A   7
LEU A  11
THR A 173
ALA A 174
LEU A 175
 None
 0.98A 2npnA-3v0tA:
undetectable		 2npnA-3v0tA:
23.81
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.
4a0l CULLIN-4B

(Homo sapiens) 		PF00888
(Cullin)
PF10557
(Cullin_Nedd8) 		5 THR E 781
LEU E 747
LEU E 754
LEU E 778
THR E 771
 None
 1.27A 2npnA-4a0lE:
undetectable		 2npnA-4a0lE:
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.
4b4u BIFUNCTIONAL PROTEIN
FOLD

(Acinetobacter
baumannii) 		PF00763
(THF_DHG_CYH)
PF02882
(THF_DHG_CYH_C) 		5 THR A 268
GLY A 144
THR A 141
ALA A 140
LEU A 269
 None
 1.16A 2npnA-4b4uA:
2.0		 2npnA-4b4uA:
22.74
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.
4bc7 ALKYLDIHYDROXYACETON
EPHOSPHATE SYNTHASE,
PEROXISOMAL

(Cavia porcellus) 		PF01565
(FAD_binding_4)
PF02913
(FAD-oxidase_C) 		5 GLY A 492
TYR A 485
ALA A 394
LEU A 468
LEU A 463
 None
 1.27A 2npnA-4bc7A:
undetectable		 2npnA-4bc7A:
19.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4bk1 PROBABLE SALICYLATE
MONOOXYGENASE

(Rhodococcus
jostii) 		PF01494
(FAD_binding_3) 		5 GLY A 221
LEU A 219
TYR A 217
ALA A  71
LEU A  68
 None
None
3HB  A1400 (-4.3A)
None
None
 1.02A 2npnA-4bk1A:
undetectable		 2npnA-4bk1A:
23.60
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.
4c3y 3-KETOSTEROID
DEHYDROGENASE

(Rhodococcus
erythropolis) 		PF00890
(FAD_binding_2) 		5 THR A 455
GLY A 459
ALA A 474
LEU A 453
THR A 478
 None
 1.25A 2npnA-4c3yA:
undetectable		 2npnA-4c3yA:
19.21
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.
4dyk AMIDOHYDROLASE

(Pseudomonas
aeruginosa) 		PF01979
(Amidohydro_1) 		5 GLY A 353
THR A 350
ALA A 349
LEU A 340
THR A 323
 None
 1.22A 2npnA-4dykA:
undetectable		 2npnA-4dykA:
22.74
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.
4f62 GERANYLTRANSTRANSFER
ASE

(Marinomonas sp.
MED121) 		PF00348
(polyprenyl_synt) 		5 THR A 194
GLY A  59
LEU A  57
ALA A 191
LEU A 192
 None
 1.08A 2npnA-4f62A:
undetectable		 2npnA-4f62A:
24.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4g6c BETA-HEXOSAMINIDASE
1

(Burkholderia
cenocepacia) 		PF00933
(Glyco_hydro_3) 		5 GLY A 107
LEU A 162
THR A 104
ALA A 105
LEU A 336
 None
 1.21A 2npnA-4g6cA:
undetectable		 2npnA-4g6cA:
20.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4g6c BETA-HEXOSAMINIDASE
1

(Burkholderia
cenocepacia) 		PF00933
(Glyco_hydro_3) 		5 GLY A 159
THR A 104
ALA A 103
LEU A  82
LEU A 152
 None
 1.30A 2npnA-4g6cA:
undetectable		 2npnA-4g6cA:
20.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4g9k ROTENONE-INSENSITIVE
NADH-UBIQUINONE
OXIDOREDUCTASE

(Saccharomyces
cerevisiae) 		PF07992
(Pyr_redox_2) 		5 LEU A 285
THR A 458
ALA A 457
LEU A 450
THR A 474
 LEU  A 285 ( 0.6A)
THR  A 458 ( 0.8A)
ALA  A 457 ( 0.0A)
LEU  A 450 ( 0.6A)
THR  A 474 ( 0.8A)
 1.22A 2npnA-4g9kA:
undetectable		 2npnA-4g9kA:
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.
4hds ARSA

(Sporomusa ovata) 		PF02277
(DBI_PRT) 		5 GLY A 142
THR A 140
ALA A 222
LEU A 223
THR A 187
 None
 1.00A 2npnA-4hdsA:
undetectable		 2npnA-4hdsA:
24.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4het HYPOTHETICAL
GLYCOSIDE HYDROLASE

(Bacteroides
thetaiotaomicron) 		PF13201
(PCMD) 		5 THR A 362
GLY A 360
TYR A 257
THR A 195
LEU A 363
 None
 1.29A 2npnA-4hetA:
undetectable		 2npnA-4hetA:
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.
4ia4 AQUAPORIN

(Spinacia
oleracea) 		PF00230
(MIP) 		5 GLY A 129
TYR A 122
THR A  48
ALA A  47
THR A  92
 None
 1.20A 2npnA-4ia4A:
undetectable		 2npnA-4ia4A:
21.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4jb6 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 2

(Pseudomonas
aeruginosa) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		5 GLY A 347
LEU A 407
THR A 168
LEU A 241
LEU A 160
 None
 1.17A 2npnA-4jb6A:
undetectable		 2npnA-4jb6A:
20.61
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.
4jrl PUTATIVE GLYCOSIDE
HYDROLASE

(Bacteroides
ovatus) 		PF13201
(PCMD) 		5 THR A 363
GLY A 361
TYR A 258
THR A 196
LEU A 364
 None
 1.29A 2npnA-4jrlA:
undetectable		 2npnA-4jrlA:
22.13
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.
4k1c VACUOLAR CALCIUM ION
TRANSPORTER

(Saccharomyces
cerevisiae) 		PF01699
(Na_Ca_ex) 		5 GLY A 102
LEU A  97
THR A 100
ALA A  99
LEU A 219
 None
 1.31A 2npnA-4k1cA:
undetectable		 2npnA-4k1cA:
21.34
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.
4kh3 ANTIGEN 43

(Escherichia
coli) 		PF16168
(AIDA) 		5 GLY A 395
THR A 379
ALA A 380
LEU A 421
THR A 383
 None
 1.19A 2npnA-4kh3A:
undetectable		 2npnA-4kh3A:
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.
4oo2 CHLOROPHENOL-4-MONOO
XYGENASE

(Streptomyces
globisporus) 		PF03241
(HpaB)
PF11794
(HpaB_N) 		5 GLY A 451
LEU A 394
ALA A 449
LEU A 324
LEU A 260
 None
 1.03A 2npnA-4oo2A:
undetectable		 2npnA-4oo2A:
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.
4q9d BENZOYLFORMATE
DECARBOXYLASE

(Mycolicibacterium
smegmatis) 		PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N) 		5 THR A  78
GLY A  77
THR A  74
ALA A  99
LEU A  35
 None
 1.27A 2npnA-4q9dA:
1.7		 2npnA-4q9dA:
20.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4x2d FIC FAMILY PROTEIN
PUTATIVE
FILAMENTATION
INDUCED BY CAMP
PROTEIN

(Clostridioides
difficile) 		PF02661
(Fic) 		5 LEU A 161
TYR A 157
LEU A 203
LEU A 118
THR A 120
 None
ATP  A 302 ( 4.8A)
ATP  A 302 (-3.7A)
None
ATP  A 302 ( 4.0A)
 1.29A 2npnA-4x2dA:
undetectable		 2npnA-4x2dA:
20.52
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.
4yv7 PERIPLASMIC BINDING
PROTEIN/LACI
TRANSCRIPTIONAL
REGULATOR

(Mycolicibacterium
smegmatis) 		PF13407
(Peripla_BP_4) 		5 GLY A 253
THR A 273
ALA A 274
LEU A 149
THR A 306
 None
 1.03A 2npnA-4yv7A:
2.8		 2npnA-4yv7A:
23.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4zdl O-PHOSPHOSERYL-TRNA(
SEC) SELENIUM
TRANSFERASE

(Homo sapiens) 		PF05889
(SepSecS) 		5 GLY A  45
LEU A 329
TYR A 334
LEU A 128
LEU A  35
 None
 1.09A 2npnA-4zdlA:
3.0		 2npnA-4zdlA:
19.64
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.
4zqg 1-DEOXY-D-XYLULOSE
5-PHOSPHATE
REDUCTOISOMERASE

(Moraxella
catarrhalis) 		PF02670
(DXP_reductoisom)
PF08436
(DXP_redisom_C)
PF13288
(DXPR_C) 		5 GLY A 118
LEU A 114
THR A 141
ALA A 142
LEU A 125
 None
 1.26A 2npnA-4zqgA:
undetectable		 2npnA-4zqgA:
24.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5bqk ICP27

(Human
alphaherpesvirus
1) 		PF05459
(Herpes_UL69) 		5 LEU A 344
THR A 382
ALA A 383
LEU A 390
LEU A 436
 None
 1.26A 2npnA-5bqkA:
undetectable		 2npnA-5bqkA:
22.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5dll AMINOPEPTIDASE N

(Francisella
tularensis) 		PF01433
(Peptidase_M1)
PF11940
(DUF3458)
PF17432
(DUF3458_C) 		5 LEU A 101
ALA A  43
LEU A  68
LEU A  30
THR A 138
 None
NA  A 917 (-3.6A)
None
None
NA  A 917 (-3.4A)
 1.19A 2npnA-5dllA:
undetectable		 2npnA-5dllA:
15.55
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.
5e9a BETA-GALACTOSIDASE

(Rahnella sp. R3) 		PF02449
(Glyco_hydro_42)
PF08532
(Glyco_hydro_42M)
PF08533
(Glyco_hydro_42C) 		5 LEU A 139
TYR A 143
THR A  87
ALA A  86
LEU A  73
 None
 1.27A 2npnA-5e9aA:
undetectable		 2npnA-5e9aA:
16.36
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.
5ey5 LBCATS-A

(synthetic
construct) 		PF00290
(Trp_syntA) 		5 THR A  33
THR A  24
ALA A  25
LEU A  78
THR A  76
 None
 1.25A 2npnA-5ey5A:
undetectable		 2npnA-5ey5A:
23.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5fji BETA-GLUCOSIDASE

(Aspergillus
fumigatus) 		PF00933
(Glyco_hydro_3)
PF01915
(Glyco_hydro_3_C)
PF14310
(Fn3-like) 		5 THR A  55
TYR A 699
ALA A  57
LEU A  56
THR A 318
 None
None
NAG  A1001 ( 4.0A)
None
None
 1.26A 2npnA-5fjiA:
undetectable		 2npnA-5fjiA:
16.22
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.
5g5g PUTATIVE XANTHINE
DEHYDROGENASE YAGR
MOLYBDENUM-BINDING
SU SUBUNIT

(Escherichia
coli) 		PF00941
(FAD_binding_5)
PF03450
(CO_deh_flav_C) 		5 GLY B 111
LEU B 113
THR B 109
ALA B  71
LEU B  56
 FAD  B 321 (-3.3A)
None
None
FAD  B 321 ( 3.8A)
None
 1.29A 2npnA-5g5gB:
undetectable		 2npnA-5g5gB:
25.16
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.
5g5g PUTATIVE XANTHINE
DEHYDROGENASE YAGR
MOLYBDENUM-BINDING
SU SUBUNIT

(Escherichia
coli) 		PF00941
(FAD_binding_5)
PF03450
(CO_deh_flav_C) 		5 LEU B 113
THR B 109
ALA B  71
LEU B 207
LEU B  56
 None
None
FAD  B 321 ( 3.8A)
None
None
 1.20A 2npnA-5g5gB:
undetectable		 2npnA-5g5gB:
25.16
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.
5hgc SERPIN

(Taeniopygia
guttata) 		PF00079
(Serpin) 		5 GLY A 325
LEU A 332
THR A 327
LEU A 189
LEU A 136
 None
 1.18A 2npnA-5hgcA:
undetectable		 2npnA-5hgcA:
18.80
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.
5hi9 TRANSIENT RECEPTOR
POTENTIAL CATION
CHANNEL SUBFAMILY V
MEMBER 2

(Rattus
norvegicus) 		PF00520
(Ion_trans)
PF12796
(Ank_2) 		5 GLY A 278
LEU A 275
TYR A 271
LEU A 253
THR A 248
 None
 1.00A 2npnA-5hi9A:
undetectable		 2npnA-5hi9A:
16.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ju6 BETA-GLUCOSIDASE

(Rasamsonia
emersonii) 		PF00933
(Glyco_hydro_3)
PF01915
(Glyco_hydro_3_C)
PF14310
(Fn3-like) 		5 THR A  55
TYR A 691
ALA A  57
LEU A  56
THR A 314
 None
None
NAG  A 901 ( 3.8A)
None
None
 1.25A 2npnA-5ju6A:
undetectable		 2npnA-5ju6A:
14.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ld5 GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE

(Atopobium
vaginae) 		PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C) 		5 THR A 228
GLY A 247
LEU A 245
ALA A 230
THR A 170
 GOL  A 404 (-4.1A)
None
None
GOL  A 404 (-3.3A)
None
 1.11A 2npnA-5ld5A:
undetectable		 2npnA-5ld5A:
21.86
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.
5mln ALCOHOL
DEHYDROGENASE 3

([Candida]
magnoliae) 		no annotation 5 GLY A  75
LEU A  62
LEU A  41
LEU A  78
THR A  32
 None
 1.30A 2npnA-5mlnA:
undetectable		 2npnA-5mlnA:
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.
5swi SUGAR HYDROLASE

(Streptococcus
pneumoniae) 		no annotation 5 LEU B  63
THR B 214
ALA B 213
LEU B 123
LEU B 226
 None
 1.31A 2npnA-5swiB:
undetectable		 2npnA-5swiB:
17.57
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.
5w1a MYOSIN HEAVY CHAIN,
MUSCLE

(Drosophila
melanogaster) 		no annotation 5 GLY A 230
LEU A 438
ALA A 228
LEU A 338
THR A 331
 None
 1.22A 2npnA-5w1aA:
1.3		 2npnA-5w1aA:
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.
5x41 COBALT ABC
TRANSPORTER
ATP-BINDING PROTEIN

(Rhodobacter
capsulatus) 		PF00005
(ABC_tran) 		5 GLY A  53
LEU A  55
TYR A  12
THR A  54
LEU A  21
 None
 1.29A 2npnA-5x41A:
undetectable		 2npnA-5x41A:
24.58
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.
6ape BIFUNCTIONAL PROTEIN
FOLD

(Helicobacter
pylori) 		PF00763
(THF_DHG_CYH)
PF02882
(THF_DHG_CYH_C) 		5 GLY A 148
THR A 145
ALA A 144
LEU A 134
LEU A 274
 None
None
GOL  A 305 ( 4.5A)
None
GOL  A 305 (-4.3A)
 1.28A 2npnA-6apeA:
2.1		 2npnA-6apeA:
21.02
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.
6bwm TRANSIENT RECEPTOR
POTENTIAL CATION
CHANNEL SUBFAMILY V
MEMBER 2

(Oryctolagus
cuniculus) 		no annotation 5 GLY A 276
LEU A 273
TYR A 269
LEU A 251
THR A 246
 None
 1.08A 2npnA-6bwmA:
undetectable		 2npnA-6bwmA:
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.
6dll P-HYDROXYBENZOATE
HYDROXYLASE

(Pseudomonas
putida) 		no annotation 5 GLY A 285
LEU A 301
ALA A 303
LEU A  16
THR A  52
 FAD  A 401 (-3.6A)
CL  A 402 (-4.8A)
None
None
None
 1.25A 2npnA-6dllA:
undetectable		 2npnA-6dllA:
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.
6ejf -

(-) 		no annotation 5 GLY J 249
TYR J 284
ALA J 286
LEU J 221
LEU J 287
 None
 1.28A 2npnA-6ejfJ:
undetectable		 2npnA-6ejfJ:
undetectable