SIMILAR PATTERNS OF AMINO ACIDS FOR 4PB1_A_RBVA501

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.
1a76 FLAP ENDONUCLEASE-1
PROTEIN

(Methanocaldococcus
jannaschii) 		PF00752
(XPG_N)
PF00867
(XPG_I) 		5 GLY A 245
ALA A 247
TYR A 258
SER A 210
ILE A 209
 None
 1.34A 4pb1A-1a76A:
0.0		 4pb1A-1a76A:
22.35
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.
1ad3 ALDEHYDE
DEHYDROGENASE (CLASS
3)

(Rattus
norvegicus) 		PF00171
(Aldedh) 		5 ALA A  46
LEU A 149
ASN A 118
GLU A  62
ILE A  36
 None
 1.20A 4pb1A-1ad3A:
0.0		 4pb1A-1ad3A:
23.29
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.
1e6y METHYL-COENZYME M
REDUCTASE SUBUNIT
ALPHA

(Methanosarcina
barkeri) 		PF02249
(MCR_alpha)
PF02745
(MCR_alpha_N) 		5 GLY A1510
GLN A1513
ALA A1509
SER A1307
ILE A1316
 None
 1.35A 4pb1A-1e6yA:
undetectable		 4pb1A-1e6yA:
22.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1f76 DIHYDROOROTATE
DEHYDROGENASE
(QUINONE)

(Escherichia
coli) 		PF01180
(DHO_dh) 		5 GLY A 294
GLN A 316
ALA A 244
ASN A 172
ASN A 139
 None
None
None
ORO  A1338 ( 3.2A)
FMN  A1337 (-3.3A)
 1.19A 4pb1A-1f76A:
0.0		 4pb1A-1f76A:
21.16
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.
1h71 SERRALYSIN

(Pseudomonas sp.
'TAC II 18') 		PF00413
(Peptidase_M10)
PF08548
(Peptidase_M10_C) 		5 GLY P 376
ALA P 403
ASN P  13
SER P  15
ILE P 338
 None
 1.24A 4pb1A-1h71P:
0.0		 4pb1A-1h71P:
23.71
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.
1kgp RIBONUCLEOTIDE
REDUCTASE PROTEIN
R2F

(Corynebacterium
ammoniagenes) 		PF00268
(Ribonuc_red_sm) 		5 GLY A  81
GLN A  80
ALA A 105
LEU A  89
SER A 164
 None
 1.21A 4pb1A-1kgpA:
1.8		 4pb1A-1kgpA:
21.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1luj CATENIN BETA-1

(Homo sapiens) 		PF00514
(Arm) 		5 GLY A 277
ALA A 276
ASN A 308
SER A 311
ILE A 314
 None
 1.13A 4pb1A-1lujA:
undetectable		 4pb1A-1lujA:
23.15
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.
1luj CATENIN BETA-1

(Homo sapiens) 		PF00514
(Arm) 		5 GLY A 278
ALA A 276
ASN A 308
SER A 311
ILE A 314
 None
 1.20A 4pb1A-1lujA:
undetectable		 4pb1A-1lujA:
23.15
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.
1m1j FIBRINOGEN GAMMA
CHAIN

(Gallus gallus) 		PF00147
(Fibrinogen_C)
PF08702
(Fib_alpha) 		5 GLY C 200
GLU C 225
ASN C 365
SER C 378
ILE C 367
 None
 1.27A 4pb1A-1m1jC:
undetectable		 4pb1A-1m1jC:
21.35
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.
1n60 CARBON MONOXIDE
DEHYDROGENASE LARGE
CHAIN

(Oligotropha
carboxidovorans) 		PF01315
(Ald_Xan_dh_C)
PF02738
(Ald_Xan_dh_C2) 		5 GLY B 354
ALA B 353
LEU B 370
GLU B 394
ILE B 358
 None
 1.31A 4pb1A-1n60B:
0.0		 4pb1A-1n60B:
20.51
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.
1ne2 HYPOTHETICAL PROTEIN
TA1320

(Thermoplasma
acidophilum) 		PF06325
(PrmA) 		5 GLY A  56
ALA A  55
TYR A 108
ASN A  95
ILE A  84
 None
 0.98A 4pb1A-1ne2A:
undetectable		 4pb1A-1ne2A:
18.87
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.
1nt4 GLUCOSE-1-PHOSPHATAS
E

(Escherichia
coli) 		PF00328
(His_Phos_2) 		5 GLY A  61
ALA A 106
LEU A  68
PHE A 102
SER A  16
 None
 1.33A 4pb1A-1nt4A:
undetectable		 4pb1A-1nt4A:
22.11
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.
1ocm MALONAMIDASE E2

(Bradyrhizobium
japonicum) 		PF01425
(Amidase) 		5 GLY A 346
GLU A 236
ALA A 238
ASN A 123
ASN A 120
 None
 1.17A 4pb1A-1ocmA:
undetectable		 4pb1A-1ocmA:
23.59
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.
1or4 HEME-BASED
AEROTACTIC
TRANSDUCER HEMAT

(Bacillus
subtilis) 		PF11563
(Protoglobin) 		5 GLN A  53
ALA A 161
LEU A  57
GLU A 157
PHE A  14
 None
 1.10A 4pb1A-1or4A:
undetectable		 4pb1A-1or4A:
19.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1r8w GLYCEROL DEHYDRATASE

(Clostridium
butyricum) 		PF01228
(Gly_radical)
PF02901
(PFL-like) 		5 GLY A 658
ASN A 584
PHE A 586
SER A 589
ILE A 592
 None
 1.15A 4pb1A-1r8wA:
undetectable		 4pb1A-1r8wA:
21.06
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.
1sqg SUN PROTEIN

(Escherichia
coli) 		PF01029
(NusB)
PF01189
(Methyltr_RsmB-F) 		5 GLY A 237
ALA A 235
LEU A 320
PHE A 421
ASN A 382
 None
 1.29A 4pb1A-1sqgA:
2.0		 4pb1A-1sqgA:
23.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1zj9 PROBABLE
FERREDOXIN-DEPENDENT
NITRITE REDUCTASE
NIRA

(Mycobacterium
tuberculosis) 		PF01077
(NIR_SIR)
PF03460
(NIR_SIR_ferr) 		5 GLN A 471
LEU A 501
ASN A 459
ASN A 461
SER A 466
 None
None
None
SF4  A 556 ( 4.9A)
None
 1.37A 4pb1A-1zj9A:
undetectable		 4pb1A-1zj9A:
25.13
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.
1zly PHOSPHORIBOSYLGLYCIN
AMIDE
FORMYLTRANSFERASE

(Homo sapiens) 		PF00551
(Formyl_trans_N) 		5 GLY A 146
GLN A 147
ALA A 140
ASN A 194
ILE A 197
 None
 1.26A 4pb1A-1zlyA:
undetectable		 4pb1A-1zlyA:
21.92
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.
1zun SULFATE
ADENYLYLTRANSFERASE
SUBUNIT 2

(Pseudomonas
syringae) 		PF01507
(PAPS_reduct) 		5 GLY A 132
ALA A 134
ASN A 187
SER A  15
ILE A  18
 AGS  A 600 ( 4.5A)
AGS  A 600 ( 4.7A)
None
None
None
 1.04A 4pb1A-1zunA:
undetectable		 4pb1A-1zunA:
20.48
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.
2a90 DELTEX PROTEIN

(Drosophila
melanogaster) 		PF02825
(WWE) 		5 ALA A 160
LEU A 170
ASN A 182
PHE A 183
ILE A 199
 None
 1.34A 4pb1A-2a90A:
undetectable		 4pb1A-2a90A:
22.36
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.
2a90 DELTEX PROTEIN

(Drosophila
melanogaster) 		PF02825
(WWE) 		5 ALA A 160
LEU A 170
PHE A 183
ASN A 185
ILE A 199
 None
 1.09A 4pb1A-2a90A:
undetectable		 4pb1A-2a90A:
22.36
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.
2cjq RNA-DIRECTED RNA
POLYMERASE

(Pestivirus A) 		PF00998
(RdRP_3) 		5 GLN A 402
GLU A 177
TYR A 256
LEU A 358
GLU A 258
 None
 1.15A 4pb1A-2cjqA:
undetectable		 4pb1A-2cjqA:
21.57
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.
2cmp TERMINASE SMALL
SUBUNIT

(Bacillus phage
SF6) 		PF03592
(Terminase_2) 		5 GLY A  32
LEU A   6
ASN A  36
SER A  37
ILE A  41
 None
 1.35A 4pb1A-2cmpA:
undetectable		 4pb1A-2cmpA:
9.69
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.
2gfn HTH-TYPE
TRANSCRIPTIONAL
REGULATOR PKSA
RELATED PROTEIN

(Rhodococcus
jostii) 		PF00440
(TetR_N)
PF13977
(TetR_C_6) 		5 GLY A  65
GLN A  68
ALA A  64
SER A  93
ILE A  94
 None
 1.33A 4pb1A-2gfnA:
2.4		 4pb1A-2gfnA:
20.76
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.
2gy7 ANGIOPOIETIN-2

(Homo sapiens) 		PF00147
(Fibrinogen_C) 		5 GLY A 331
GLU A 352
ASN A 470
SER A 483
ILE A 472
 None
 1.29A 4pb1A-2gy7A:
undetectable		 4pb1A-2gy7A:
17.52
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.
2gz3 ASPARTATE
BETA-SEMIALDEHYDE
DEHYDROGENASE

(Streptococcus
pneumoniae) 		PF01118
(Semialdhyde_dh)
PF02774
(Semialdhyde_dhC) 		5 GLY A  12
ALA A  16
ASN A 325
SER A 158
ILE A 165
 NAP  A 367 (-3.3A)
None
NAP  A 367 (-4.0A)
None
None
 1.17A 4pb1A-2gz3A:
undetectable		 4pb1A-2gz3A:
22.25
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.
2ho5 OXIDOREDUCTASE,
GFO/IDH/MOCA FAMILY

(Streptococcus
pneumoniae) 		PF01408
(GFO_IDH_MocA) 		5 GLN A  78
LEU A 105
ASN A  72
SER A  70
ILE A  68
 None
 0.93A 4pb1A-2ho5A:
undetectable		 4pb1A-2ho5A:
21.35
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.
2ool SENSOR PROTEIN

(Rhodopseudomonas
palustris) 		PF01590
(GAF)
PF08446
(PAS_2) 		5 GLY A 294
GLN A 186
LEU A 321
GLU A 329
ILE A 196
 None
 1.29A 4pb1A-2oolA:
undetectable		 4pb1A-2oolA:
22.82
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.
2vmj DISSIMILATORY
COPPER-CONTAINING
NITRITE REDUCTASE

(Achromobacter
xylosoxidans) 		PF00394
(Cu-oxidase)
PF07732
(Cu-oxidase_3) 		5 GLY A 254
ALA A 276
TYR A 158
PHE A 256
SER A 123
 None
 1.13A 4pb1A-2vmjA:
undetectable		 4pb1A-2vmjA:
20.66
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.
2wnp FICOLIN-1

(Homo sapiens) 		PF00147
(Fibrinogen_C) 		5 GLY F 135
GLU F 156
ASN F 273
SER F 286
ILE F 275
 None
 1.23A 4pb1A-2wnpF:
undetectable		 4pb1A-2wnpF:
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.
2z6h CATENIN BETA-1

(Homo sapiens) 		PF00514
(Arm) 		5 GLY A 277
ALA A 276
ASN A 308
SER A 311
ILE A 314
 None
 1.18A 4pb1A-2z6hA:
undetectable		 4pb1A-2z6hA:
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.
3bvh FIBRINOGEN GAMMA
CHAIN

(Homo sapiens) 		PF00147
(Fibrinogen_C)
PF08702
(Fib_alpha) 		5 GLY C 200
GLU C 225
ASN C 365
SER C 378
ILE C 367
 None
 1.21A 4pb1A-3bvhC:
undetectable		 4pb1A-3bvhC:
19.37
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.
3chx PMOA
PMOC

(Methylosinus
trichosporium) 		PF02461
(AMO)
PF04896
(AmoC) 		5 GLY C 121
ALA C 122
LEU B  39
GLU C 127
ASN B 112
 None
 1.36A 4pb1A-3chxC:
undetectable		 4pb1A-3chxC:
21.90
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.
3d1j GLYCOGEN SYNTHASE

(Escherichia
coli) 		PF00534
(Glycos_transf_1)
PF08323
(Glyco_transf_5) 		5 GLY A 227
ALA A 225
TYR A 215
LEU A 202
ASN A 162
 None
 1.02A 4pb1A-3d1jA:
undetectable		 4pb1A-3d1jA:
23.47
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.
3d54 PHOSPHORIBOSYLFORMYL
GLYCINAMIDINE
SYNTHASE 1

(Thermotoga
maritima) 		PF13507
(GATase_5) 		5 GLY D 200
LEU D 183
PHE D 130
ASN D 128
SER D 206
 None
 1.15A 4pb1A-3d54D:
undetectable		 4pb1A-3d54D:
19.75
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.
3e0m PEPTIDE METHIONINE
SULFOXIDE REDUCTASE
MSRA/MSRB 1

(Streptococcus
pneumoniae) 		PF01625
(PMSR)
PF01641
(SelR) 		5 GLY A  30
ALA A 134
TYR A 137
LEU A  44
PHE A  11
 None
 1.36A 4pb1A-3e0mA:
undetectable		 4pb1A-3e0mA:
19.27
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.
3fqd 5'-3'
EXORIBONUCLEASE 2

(Schizosaccharomyces
pombe) 		PF03159
(XRN_N) 		5 GLY A 388
ALA A 647
TYR A 617
LEU A 344
ILE A 357
 None
 1.30A 4pb1A-3fqdA:
undetectable		 4pb1A-3fqdA:
19.01
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.
3ghg FIBRINOGEN GAMMA
CHAIN

(Homo sapiens) 		PF00147
(Fibrinogen_C)
PF08702
(Fib_alpha) 		5 GLY C 200
GLU C 225
ASN C 365
SER C 378
ILE C 367
 GLY  C 200 ( 0.0A)
GLU  C 225 ( 0.5A)
ASN  C 365 ( 0.6A)
SER  C 378 ( 0.0A)
ILE  C 367 ( 0.5A)
 1.26A 4pb1A-3ghgC:
undetectable		 4pb1A-3ghgC:
19.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3gri DIHYDROOROTASE

(Staphylococcus
aureus) 		PF01979
(Amidohydro_1) 		5 GLY A 143
GLN A 107
ALA A 144
PHE A 103
ILE A 110
 None
 1.35A 4pb1A-3griA:
undetectable		 4pb1A-3griA:
23.47
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.
3ifq PLAKOGLOBIN

(Homo sapiens) 		PF00514
(Arm) 		5 GLY A 269
ALA A 267
ASN A 299
SER A 302
ILE A 305
 None
 1.01A 4pb1A-3ifqA:
undetectable		 4pb1A-3ifqA:
22.05
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.
3jys SUSD SUPERFAMILY
PROTEIN

(Bacteroides
vulgatus) 		PF07980
(SusD_RagB)
PF14322
(SusD-like_3) 		5 GLY A 471
GLU A  95
LEU A 484
GLU A 421
ILE A 479
 None
 1.12A 4pb1A-3jysA:
undetectable		 4pb1A-3jysA:
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.
3kwl UNCHARACTERIZED
PROTEIN

(Helicobacter
pylori) 		no annotation 5 ALA A 311
TYR A 351
LEU A 250
GLU A 309
ASN A 402
 None
 1.26A 4pb1A-3kwlA:
undetectable		 4pb1A-3kwlA:
24.82
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.
3kya PUTATIVE PHOSPHATASE

(Bacteroides
thetaiotaomicron) 		PF01833
(TIG) 		5 GLY A 273
GLN A 336
ALA A 232
ASN A 163
ILE A 351
 None
None
None
CL  A  21 (-4.4A)
CL  A  21 (-4.4A)
 1.31A 4pb1A-3kyaA:
undetectable		 4pb1A-3kyaA:
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.
3mjo RIBONUCLEOTIDE
REDUCTASE SUBUNIT
R2F

(Corynebacterium
ammoniagenes) 		PF00268
(Ribonuc_red_sm) 		5 GLY A  81
GLN A  80
ALA A 105
LEU A  89
SER A 164
 None
 1.18A 4pb1A-3mjoA:
undetectable		 4pb1A-3mjoA:
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.
3o0y LIPOPROTEIN

(Colwellia
psychrerythraea) 		PF05960
(DUF885) 		5 GLY A 443
GLN A 447
TYR A 556
GLU A 471
ILE A 448
 None
None
SO4  A 610 (-4.2A)
SO4  A 610 ( 4.2A)
None
 1.37A 4pb1A-3o0yA:
undetectable		 4pb1A-3o0yA:
22.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3q9o EXOTOXIN A

(Vibrio cholerae) 		PF09009
(Exotox-A_cataly)
PF09101
(Exotox-A_bind)
PF09102
(Exotox-A_target) 		5 GLY A 204
GLN A 259
GLU A 414
SER A 148
ILE A 261
 None
 1.10A 4pb1A-3q9oA:
undetectable		 4pb1A-3q9oA:
20.34
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.
3s6k ACETYLGLUTAMATE
KINASE

(Xanthomonas
campestris) 		PF00696
(AA_kinase)
PF04768
(NAT) 		5 GLY A 294
TYR A  31
LEU A 260
SER A 229
ILE A 230
 None
 1.33A 4pb1A-3s6kA:
undetectable		 4pb1A-3s6kA:
26.16
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.
3sdq ALPHA-BISABOLENE
SYNTHASE

(Abies grandis) 		PF01397
(Terpene_synth)
PF03936
(Terpene_synth_C) 		5 GLY A 385
GLN A 386
GLU A 430
ASN A 436
ILE A 476
 None
None
None
None
GOL  A 820 (-4.5A)
 1.36A 4pb1A-3sdqA:
undetectable		 4pb1A-3sdqA:
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.
3she MAP KINASE-ACTIVATED
PROTEIN KINASE 3

(Homo sapiens) 		PF00069
(Pkinase) 		5 GLY A 151
ALA A 153
LEU A 183
ASN A 171
ILE A 231
 None
None
None
I85  A 350 (-4.4A)
None
 1.14A 4pb1A-3sheA:
undetectable		 4pb1A-3sheA:
20.19
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3tij NUPC FAMILY PROTEIN

(Vibrio cholerae) 		PF01773
(Nucleos_tra2_N)
PF07662
(Nucleos_tra2_C)
PF07670
(Gate) 		5 ALA A 185
LEU A 105
ASN A 331
GLU A 332
PHE A 366
 URI  A 419 ( 3.8A)
None
URI  A 419 ( 4.0A)
URI  A 419 (-3.0A)
URI  A 419 (-3.9A)
 1.03A 4pb1A-3tijA:
72.1		 4pb1A-3tijA:
99.53
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3tij NUPC FAMILY PROTEIN

(Vibrio cholerae) 		PF01773
(Nucleos_tra2_N)
PF07662
(Nucleos_tra2_C)
PF07670
(Gate) 		12 GLY A 153
GLN A 154
GLU A 156
ALA A 185
TYR A 192
LEU A 259
ASN A 331
GLU A 332
PHE A 366
ASN A 368
SER A 371
ILE A 374
 NA  A 421 ( 3.9A)
URI  A 419 (-3.9A)
URI  A 419 ( 4.3A)
URI  A 419 ( 3.8A)
None
URI  A 419 ( 4.9A)
URI  A 419 ( 4.0A)
URI  A 419 (-3.0A)
URI  A 419 (-3.9A)
URI  A 419 (-3.7A)
URI  A 419 (-2.6A)
URI  A 419 (-4.0A)
 0.17A 4pb1A-3tijA:
72.1		 4pb1A-3tijA:
99.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3uoe DEHYDROGENASE

(Sinorhizobium
meliloti) 		PF02615
(Ldh_2) 		5 GLY A 182
LEU A 253
ASN A 157
SER A 177
ILE A 218
 None
 1.28A 4pb1A-3uoeA:
undetectable		 4pb1A-3uoeA:
26.71
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.
3uvf INTRON-ENCODED DNA
ENDONUCLEASE I-HJEMI

(Trichoderma
reesei) 		PF00961
(LAGLIDADG_1) 		5 GLY A 151
LEU A 143
ASN A 213
PHE A 169
ILE A 218
 None
 0.91A 4pb1A-3uvfA:
undetectable		 4pb1A-3uvfA:
20.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3vd8 MALTOSE-BINDING
PERIPLASMIC PROTEIN,
INTERFERON-INDUCIBLE
PROTEIN AIM2

(Escherichia
coli;
Homo sapiens) 		PF02758
(PYRIN)
PF13416
(SBP_bac_8) 		5 GLY A  19
GLU A  22
ALA A 292
TYR A 307
SER A 233
 None
 1.28A 4pb1A-3vd8A:
undetectable		 4pb1A-3vd8A:
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.
3vw5 CELLOBIOSE
2-EPIMERASE

(Ruminococcus
albus) 		PF07221
(GlcNAc_2-epim) 		5 GLY A 242
LEU A 183
ASN A 315
SER A 275
ILE A 274
 None
 1.09A 4pb1A-3vw5A:
undetectable		 4pb1A-3vw5A:
21.91
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.
4bc7 ALKYLDIHYDROXYACETON
EPHOSPHATE SYNTHASE,
PEROXISOMAL

(Cavia porcellus) 		PF01565
(FAD_binding_4)
PF02913
(FAD-oxidase_C) 		5 GLY A 493
ALA A 488
LEU A 468
PHE A 395
SER A 464
 None
 1.01A 4pb1A-4bc7A:
undetectable		 4pb1A-4bc7A:
22.49
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.
4epu ANGIOPOIETIN-1

(Homo sapiens) 		PF00147
(Fibrinogen_C) 		5 GLY A 333
GLU A 354
ASN A 472
SER A 485
ILE A 474
 None
 1.20A 4pb1A-4epuA:
undetectable		 4pb1A-4epuA:
19.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4f5x RNA-DIRECTED RNA
POLYMERASE

(Rotavirus A) 		PF02123
(RdRP_4)
PF12289
(Rotavirus_VP1) 		5 GLY W 702
TYR W1080
LEU W 135
ASN W 840
SER W 846
 None
 1.35A 4pb1A-4f5xW:
1.1		 4pb1A-4f5xW:
16.79
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.
4fod ALK TYROSINE KINASE
RECEPTOR

(Homo sapiens) 		PF07714
(Pkinase_Tyr) 		5 GLY A1304
ALA A1300
LEU A1291
PHE A1306
ILE A1277
 None
 1.28A 4pb1A-4fodA:
undetectable		 4pb1A-4fodA:
22.68
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.
4g9b BETA-PHOSPHOGLUCOMUT
ASE

(Escherichia
coli) 		PF13419
(HAD_2) 		5 GLY A 176
GLU A 171
ALA A 175
ASN A 145
ILE A 152
 None
MG  A 301 ( 4.1A)
None
None
None
 1.35A 4pb1A-4g9bA:
undetectable		 4pb1A-4g9bA:
19.72
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.
4gxb SORTING NEXIN-17

(Homo sapiens) 		no annotation 5 ALA A 292
LEU A 376
PHE A 274
SER A 366
ILE A 364
 None
 1.24A 4pb1A-4gxbA:
undetectable		 4pb1A-4gxbA:
23.09
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.
4i8v CYTOCHROME P450 1A1

(Homo sapiens) 		PF00067
(p450) 		5 GLY A 316
ALA A 317
LEU A 496
SER A 120
ILE A 115
 BHF  A 602 (-3.5A)
BHF  A 602 ( 3.4A)
None
BHF  A 602 ( 4.5A)
BHF  A 602 (-4.7A)
 1.11A 4pb1A-4i8vA:
1.5		 4pb1A-4i8vA:
22.82
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.
4iin 3-KETOACYL-ACYL
CARRIER PROTEIN
REDUCTASE (FABG)

(Helicobacter
pylori) 		PF13561
(adh_short_C2) 		5 GLY A 173
ASN A  89
PHE A 180
ASN A 139
SER A 166
 None
 1.09A 4pb1A-4iinA:
undetectable		 4pb1A-4iinA:
22.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4kl0 PUTATIVE
UNCHARACTERIZED
PROTEIN

(Xanthomonas
oryzae) 		PF01156
(IU_nuc_hydro) 		5 GLY A 432
ALA A 309
ASN A 280
ASN A 281
ILE A 304
 None
None
CA  A 501 ( 4.5A)
None
None
 1.29A 4pb1A-4kl0A:
undetectable		 4pb1A-4kl0A:
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.
4lk4 VESB PROTEASE

(Vibrio cholerae) 		PF00089
(Trypsin) 		5 GLY A 161
GLN A 178
ALA A 160
ASN A  40
ILE A 176
 None
 1.23A 4pb1A-4lk4A:
undetectable		 4pb1A-4lk4A:
21.65
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.
4oc9 PUTATIVE
O-ACETYLHOMOSERINE
(THIOL)-LYASE

(Campylobacter
jejuni) 		PF01053
(Cys_Met_Meta_PP) 		5 ALA A 161
TYR A 332
LEU A 134
SER A 177
ILE A 148
 None
 1.19A 4pb1A-4oc9A:
undetectable		 4pb1A-4oc9A:
24.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ofl EXTRACYTOPLASMIC
NICKEL-BINDING
PROTEIN YPYNTA

(Yersinia pestis) 		PF00496
(SBP_bac_5) 		5 ALA A 457
LEU A 355
ASN A 250
PHE A 233
ILE A 258
 None
 1.28A 4pb1A-4oflA:
undetectable		 4pb1A-4oflA:
23.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ofl EXTRACYTOPLASMIC
NICKEL-BINDING
PROTEIN YPYNTA

(Yersinia pestis) 		PF00496
(SBP_bac_5) 		5 ALA A 457
LEU A 355
PHE A 233
ASN A 250
ILE A 258
 None
 1.12A 4pb1A-4oflA:
undetectable		 4pb1A-4oflA:
23.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4pr3 5'-METHYLTHIOADENOSI
NE NUCLEOSIDASE /
S-ADENOSYLHOMOCYSTEI
NE NUCLEOSIDASE

(Brucella
melitensis) 		PF01048
(PNP_UDP_1) 		5 GLY A  67
ALA A  66
LEU A 122
ASN A 127
ILE A 137
 ADE  A 501 (-3.7A)
ADE  A 501 (-4.9A)
None
None
PO4  A 502 (-3.4A)
 1.12A 4pb1A-4pr3A:
undetectable		 4pb1A-4pr3A:
20.93
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.
4qus ACETYLTRANSFERASE
YPEA

(Escherichia
coli) 		PF00583
(Acetyltransf_1) 		5 GLY A  60
ALA A  69
TYR A 123
ASN A  89
GLU A  92
 None
 1.24A 4pb1A-4qusA:
undetectable		 4pb1A-4qusA:
15.96
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.
4qus ACETYLTRANSFERASE
YPEA

(Escherichia
coli) 		PF00583
(Acetyltransf_1) 		5 GLY A  60
TYR A 123
LEU A  72
ASN A  89
GLU A  92
 None
 1.23A 4pb1A-4qusA:
undetectable		 4pb1A-4qusA:
15.96
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.
4r9j FICOLIN-2

(Homo sapiens) 		no annotation 5 GLY G 126
GLU G 147
ASN G 264
SER G 277
ILE G 266
 None
 1.22A 4pb1A-4r9jG:
undetectable		 4pb1A-4r9jG:
18.91
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.
4rv2 MAOC FAMILY PROTEIN

(Mycolicibacterium
smegmatis) 		PF01575
(MaoC_dehydratas) 		5 GLY B  59
ALA B  57
LEU B  65
ASN B  29
SER B  34
 SO4  B 201 (-3.5A)
None
None
None
None
 1.25A 4pb1A-4rv2B:
undetectable		 4pb1A-4rv2B:
15.80
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.
4xb6 ALPHA-D-RIBOSE
1-METHYLPHOSPHONATE
5-TRIPHOSPHATE
SYNTHASE SUBUNIT
PHNI

(Escherichia
coli) 		PF05861
(PhnI) 		5 GLN C 195
GLU C 321
ALA C 315
SER C 191
ILE C 178
 None
 1.31A 4pb1A-4xb6C:
undetectable		 4pb1A-4xb6C:
23.26
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.
5aza MALTOSE-BINDING
PERIPLASMIC
PROTEIN,OLIGOSACCHAR
YL TRANSFERASE STT3
SUBUNIT RELATED
PROTEIN

(Escherichia
coli;
Pyrococcus
furiosus) 		PF13416
(SBP_bac_8) 		5 GLY A  19
GLU A  22
ALA A 292
TYR A 307
SER A 233
 None
 1.29A 4pb1A-5azaA:
undetectable		 4pb1A-5azaA:
19.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5b01 MOEN5

(Streptomyces
viridosporus) 		no annotation 5 GLY A 154
ALA A 157
LEU A  99
ASN A   8
ILE A  63
 None
 1.30A 4pb1A-5b01A:
undetectable		 4pb1A-5b01A:
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.
5b0l MOEN5,DNA-BINDING
PROTEIN 7D

(Streptomyces
viridosporus;
Sulfolobus
solfataricus) 		no annotation 5 GLY A 154
ALA A 157
LEU A  99
ASN A   8
ILE A  63
 None
 1.35A 4pb1A-5b0lA:
2.4		 4pb1A-5b0lA:
22.05
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.
5csa ACETYL-COA
CARBOXYLASE

(Saccharomyces
cerevisiae) 		PF00364
(Biotin_lipoyl)
PF08326
(ACC_central) 		5 GLY A1032
GLN A1031
ALA A1033
TYR A1080
ASN A1317
 None
 1.31A 4pb1A-5csaA:
undetectable		 4pb1A-5csaA:
19.43
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.
5d9a POLYMERASE BASIC
PROTEIN 2
RNA-DIRECTED RNA
POLYMERASE CATALYTIC
SUBUNIT

(Influenza C
virus) 		PF00602
(Flu_PB1)
PF00604
(Flu_PB2) 		5 GLY C 745
GLN C 744
ALA B 713
PHE B 696
SER B 698
 None
 1.23A 4pb1A-5d9aC:
undetectable		 4pb1A-5d9aC:
21.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5fjj BETA-GLUCOSIDASE

(Aspergillus
oryzae) 		PF00933
(Glyco_hydro_3)
PF01915
(Glyco_hydro_3_C)
PF14310
(Fn3-like) 		5 GLN A 577
ALA A 447
LEU A  96
ASN A 456
PHE A 457
 None
None
None
CL  A6001 (-3.8A)
None
 1.16A 4pb1A-5fjjA:
undetectable		 4pb1A-5fjjA:
20.28
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.
5gwj DNA TOPOISOMERASE
2-BETA

(Homo sapiens) 		PF00521
(DNA_topoisoIV)
PF01751
(Toprim)
PF16898
(TOPRIM_C) 		5 GLY A 813
ALA A 816
ASN A 798
ASN A 795
SER A 794
 None
None
None
MG  A1304 ( 4.8A)
None
 1.36A 4pb1A-5gwjA:
2.5		 4pb1A-5gwjA:
19.43
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.
5hsg PUTATIVE ABC
TRANSPORTER,
NUCLEOTIDE
BINDING/ATPASE
PROTEIN

(Klebsiella
pneumoniae) 		PF13407
(Peripla_BP_4) 		5 GLY A 231
GLN A 201
ALA A 232
TYR A 264
GLU A 237
 None
 1.36A 4pb1A-5hsgA:
undetectable		 4pb1A-5hsgA:
24.71
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.
5jm6 AMINOPEPTIDASE-LIKE
PROTEIN

(Chaetomium
thermophilum) 		PF02127
(Peptidase_M18) 		5 GLY A 132
ALA A 334
LEU A 387
PHE A 336
SER A 343
 None
 1.38A 4pb1A-5jm6A:
undetectable		 4pb1A-5jm6A:
23.54
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.
5jon MALTOSE-BINDING
PERIPLASMIC
PROTEIN,POTASSIUM/SO
DIUM
HYPERPOLARIZATION-AC
TIVATED CYCLIC
NUCLEOTIDE-GATED
CHANNEL 2

(Escherichia
coli;
Mus musculus) 		PF00027
(cNMP_binding)
PF13416
(SBP_bac_8) 		5 GLY A-350
GLU A-347
ALA A -77
TYR A -62
SER A-136
 None
 1.35A 4pb1A-5jonA:
undetectable		 4pb1A-5jonA:
22.62
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.
5ju6 BETA-GLUCOSIDASE

(Rasamsonia
emersonii) 		PF00933
(Glyco_hydro_3)
PF01915
(Glyco_hydro_3_C)
PF14310
(Fn3-like) 		5 GLN A 572
ALA A 442
LEU A  95
ASN A 451
PHE A 452
 None
 1.13A 4pb1A-5ju6A:
undetectable		 4pb1A-5ju6A:
20.47
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5l26 NUCLEOSIDE PERMEASE

(Neisseria
wadsworthii) 		PF01773
(Nucleos_tra2_N)
PF07662
(Nucleos_tra2_C)
PF07670
(Gate) 		9 GLY A 153
GLN A 154
ALA A 185
TYR A 192
ASN A 331
GLU A 332
PHE A 366
ASN A 368
SER A 371
 NA  A 506 (-3.8A)
URI  A 505 (-3.9A)
URI  A 505 ( 3.7A)
None
URI  A 505 ( 4.7A)
URI  A 505 (-3.2A)
URI  A 505 (-3.8A)
URI  A 505 (-3.2A)
URI  A 505 (-2.4A)
 0.41A 4pb1A-5l26A:
63.9		 4pb1A-5l26A:
67.14
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5l26 NUCLEOSIDE PERMEASE

(Neisseria
wadsworthii) 		PF01773
(Nucleos_tra2_N)
PF07662
(Nucleos_tra2_C)
PF07670
(Gate) 		6 GLY A 153
GLU A 156
ALA A 185
TYR A 192
GLU A 332
PHE A 366
 NA  A 506 (-3.8A)
None
URI  A 505 ( 3.7A)
None
URI  A 505 (-3.2A)
URI  A 505 (-3.8A)
 0.83A 4pb1A-5l26A:
63.9		 4pb1A-5l26A:
67.14
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.
5ll7 BETA-LACTAMASE

(Escherichia
coli) 		no annotation 5 GLY A  74
ALA A  77
LEU A 148
ASN A 136
ASN A 132
 None
None
None
None
6YV  A 301 (-3.7A)
 1.37A 4pb1A-5ll7A:
undetectable		 4pb1A-5ll7A:
13.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5m41 NIGRITOXINE

(Vibrio
nigripulchritudo) 		no annotation 5 GLY A  82
GLU A 135
TYR A  41
ASN A 104
ASN A 102
 None
 1.29A 4pb1A-5m41A:
undetectable		 4pb1A-5m41A:
11.89
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.
5nii THIOREDOXIN
REDUCTASE

(Desulfovibrio
vulgaris) 		no annotation 5 GLY A 148
ALA A 226
GLU A 229
SER A 177
ILE A 178
 None
 1.09A 4pb1A-5niiA:
undetectable		 4pb1A-5niiA:
11.61
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.
5nnz DYNEIN ASSEMBLY
FACTOR WITH WDR
REPEAT DOMAINS 1

(Homo sapiens) 		no annotation 5 GLY B 363
ALA B 369
ASN B 354
SER B 352
ILE B 351
 None
 1.25A 4pb1A-5nnzB:
undetectable		 4pb1A-5nnzB:
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.
5o6b ATP-DEPENDENT DNA
HELICASE PIF1

(Saccharomyces
cerevisiae) 		no annotation 5 GLY A 726
GLN A 727
LEU A 732
SER A 463
ILE A 704
 None
 1.16A 4pb1A-5o6bA:
undetectable		 4pb1A-5o6bA:
13.10
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.
5o6v ENVELOPE PROTEIN

(Tick-borne
encephalitis
virus) 		no annotation 5 GLY A 177
TYR A 304
ASN A 366
GLU A 365
ASN A 367
 None
 1.32A 4pb1A-5o6vA:
undetectable		 4pb1A-5o6vA:
11.41
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.
5w66 RNA POLYMERASE
I-SPECIFIC
TRANSCRIPTION
INITIATION FACTOR
RRN7

(Saccharomyces
cerevisiae) 		no annotation 5 GLY P 224
ALA P 492
LEU P 304
SER P 163
ILE P 230
 None
 1.24A 4pb1A-5w66P:
undetectable		 4pb1A-5w66P:
21.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5xct VH(S112C)-SARAH
CHIMERA
VL-SARAH(S37C)CHIMER
A

(Homo sapiens;
Mus musculus) 		PF07686
(V-set)
PF11629
(Mst1_SARAH) 		5 GLY A  33
GLN A  35
ALA A  32
LEU A   4
ASN B  34
 None
 1.24A 4pb1A-5xctA:
undetectable		 4pb1A-5xctA:
19.04
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.
5xd0 GLUCANASE

(Paenibacillus
sp. X4) 		PF01270
(Glyco_hydro_8) 		5 GLY A 354
GLU A 387
TYR A 341
ASN A 336
ASN A 333
 None
 1.26A 4pb1A-5xd0A:
undetectable		 4pb1A-5xd0A:
19.83
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.
5yfb DIPEPTIDYL PEPTIDASE
3

(Armillaria
tabescens) 		no annotation 5 GLY A 275
ALA A 291
TYR A 390
ASN A 202
SER A 282
 None
 1.24A 4pb1A-5yfbA:
1.3		 4pb1A-5yfbA:
10.02
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.
6bp2 ENVELOPE
GLYCOPROTEIN
MR191 FAB HEAVY
CHAIN

(Homo sapiens;
Marburg
marburgvirus) 		no annotation 5 GLY A 127
GLN A 128
TYR H  61
LEU H 110
SER H  56
 None
 1.19A 4pb1A-6bp2A:
undetectable		 4pb1A-6bp2A:
12.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6day DIHYDROPTEROATE
SYNTHASE

(Xanthomonas
albilineans) 		no annotation 5 GLY A 222
ALA A 221
PHE A 193
SER A 228
ILE A 229
 None
 1.10A 4pb1A-6dayA:
undetectable		 4pb1A-6dayA:
12.07
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.
6f0k ACTD

(Rhodothermus
marinus) 		no annotation 5 GLY D  97
GLN D  93
ALA D  98
PHE D 111
SER D 116
 None
 1.36A 4pb1A-6f0kD:
undetectable		 4pb1A-6f0kD:
12.02