SIMILAR PATTERNS OF AMINO ACIDS FOR 6BXN_B_SAMB901_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.
1e0t PYRUVATE KINASE

(Escherichia
coli) 		PF00224
(PK)
PF02887
(PK_C) 		5 LEU A 432
GLY A 433
SER A 383
VAL A 387
ILE A 374
 None
None
SO4  A 701 (-3.2A)
None
None
 1.24A 6bxnB-1e0tA:
undetectable		 6bxnB-1e0tA:
20.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1gff BACTERIOPHAGE G4
CAPSID PROTEINS GPF,
GPG, GPJ

(Escherichia
virus G4) 		PF02305
(Phage_F) 		5 LEU 1 365
GLY 1 367
SER 1 256
GLN 1 259
ARG 1  55
 None
 1.42A 6bxnB-1gff1:
undetectable		 6bxnB-1gff1:
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.
1hjq BETA-1,4-GALACTANASE

(Humicola
insolens) 		PF07745
(Glyco_hydro_53) 		5 LEU A  74
GLY A  75
GLN A  46
VAL A  48
ILE A  78
 None
 1.33A 6bxnB-1hjqA:
undetectable		 6bxnB-1hjqA:
22.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1hwn EBULIN

(Sambucus ebulus) 		PF00161
(RIP) 		5 LEU A 132
GLY A 133
SER A  69
VAL A  67
ILE A 141
 None
 1.34A 6bxnB-1hwnA:
undetectable		 6bxnB-1hwnA:
23.21
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.
1mjf SPERMIDINE SYNTHASE

(Pyrococcus
furiosus) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		5 GLY A  83
SER A  27
GLN A  30
ILE A 105
ASP A 141
 None
 1.23A 6bxnB-1mjfA:
3.1		 6bxnB-1mjfA:
24.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1nr0 ACTIN INTERACTING
PROTEIN 1

(Caenorhabditis
elegans) 		PF00400
(WD40)
PF12894
(ANAPC4_WD40) 		5 GLY A 226
SER A 256
LYS A 264
VAL A 242
ASP A 211
 None
 1.20A 6bxnB-1nr0A:
undetectable		 6bxnB-1nr0A:
19.67
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.
1nr6 CYTOCHROME P450 2C5

(Oryctolagus
cuniculus) 		PF00067
(p450) 		5 LEU A 437
GLY A 436
SER A 306
ILE A 349
ASP A 346
 HEM  A 500 ( 4.3A)
None
None
None
None
 1.38A 6bxnB-1nr6A:
undetectable		 6bxnB-1nr6A:
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.
1rt8 FIMBRIN

(Schizosaccharomyces
pombe) 		PF00307
(CH) 		5 LEU A 233
GLY A 232
VAL A 193
ARG A 231
ILE A 159
 None
 1.43A 6bxnB-1rt8A:
undetectable		 6bxnB-1rt8A:
21.29
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.
1s5t DIHYDRODIPICOLINATE
SYNTHASE

(Escherichia
coli) 		PF00701
(DHDPS) 		5 PHE A   2
LEU A 183
GLY A 199
VAL A  40
ILE A   6
 None
 1.44A 6bxnB-1s5tA:
undetectable		 6bxnB-1s5tA:
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.
1tz7 4-ALPHA-GLUCANOTRANS
FERASE

(Aquifex
aeolicus) 		PF02446
(Glyco_hydro_77) 		5 LEU A  13
GLY A  20
LYS A 191
VAL A 184
ILE A  71
 None
 1.26A 6bxnB-1tz7A:
undetectable		 6bxnB-1tz7A:
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.
1u7n FATTY
ACID/PHOSPHOLIPID
SYNTHESIS PROTEIN
PLSX

(Enterococcus
faecalis) 		PF02504
(FA_synthesis) 		5 LEU A 108
SER A  96
LYS A 295
ILE A  61
ASP A  65
 None
 1.38A 6bxnB-1u7nA:
3.3		 6bxnB-1u7nA:
22.29
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.
1vgp 373AA LONG
HYPOTHETICAL CITRATE
SYNTHASE

(Sulfurisphaera
tokodaii) 		PF00285
(Citrate_synt) 		5 LEU A 267
VAL A 337
ARG A 263
ILE A 178
ASP A 179
 None
 1.21A 6bxnB-1vgpA:
undetectable		 6bxnB-1vgpA:
23.10
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.
1wi2 RIKEN CDNA
2700099C19

(Mus musculus) 		PF00595
(PDZ) 		5 LEU A  41
GLY A  42
VAL A  48
ILE A  45
ASP A  63
 None
 1.36A 6bxnB-1wi2A:
undetectable		 6bxnB-1wi2A:
21.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1xj5 SPERMIDINE SYNTHASE
1

(Arabidopsis
thaliana) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		5 GLY A 129
SER A  73
GLN A  76
ILE A 152
ASP A 182
 None
 1.31A 6bxnB-1xj5A:
3.2		 6bxnB-1xj5A:
21.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ysj PROTEIN YXEP

(Bacillus
subtilis) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		5 PHE A  25
HIS A  96
LYS A  52
VAL A 142
ASP A 326
 None
 1.34A 6bxnB-1ysjA:
undetectable		 6bxnB-1ysjA:
22.89
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.
2asu HEPATOCYTE GROWTH
FACTOR-LIKE PROTEIN

(Homo sapiens) 		PF00089
(Trypsin) 		5 LEU B 498
GLY B 508
HIS B 505
SER B 567
ILE B 680
 None
 1.33A 6bxnB-2asuB:
undetectable		 6bxnB-2asuB:
21.82
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.
2bg5 PHOSPHOENOLPYRUVATE-
PROTEIN KINASE

(Caldanaerobacter
subterraneus) 		PF02896
(PEP-utilizers_C) 		5 LEU A 355
GLY A 356
SER A 395
ARG A 358
ILE A 360
 None
 1.38A 6bxnB-2bg5A:
undetectable		 6bxnB-2bg5A:
23.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2bg9 ACETYLCHOLINE
RECEPTOR PROTEIN,
ALPHA CHAIN

(Torpedo
marmorata) 		PF02931
(Neur_chan_LBD)
PF02932
(Neur_chan_memb) 		5 LEU A  35
GLY A  34
VAL A 156
ILE A  31
ASP A  30
 None
 1.19A 6bxnB-2bg9A:
undetectable		 6bxnB-2bg9A:
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.
2bri URIDYLATE KINASE

(Pyrococcus
furiosus) 		PF00696
(AA_kinase) 		5 PHE A   5
LEU A  12
GLY A   8
VAL A 213
ILE A 202
 None
None
ANP  A1226 (-3.4A)
None
None
 1.28A 6bxnB-2briA:
3.3		 6bxnB-2briA:
23.21
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.
2dm9 V-TYPE ATP SYNTHASE
SUBUNIT E

(Pyrococcus
horikoshii) 		PF01991
(vATP-synt_E) 		5 LEU A 133
GLY A 132
LYS A 111
VAL A 148
ILE A 150
 None
 1.45A 6bxnB-2dm9A:
3.1		 6bxnB-2dm9A:
23.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2e3d UTP--GLUCOSE-1-PHOSP
HATE
URIDYLYLTRANSFERASE

(Escherichia
coli) 		PF00483
(NTP_transferase) 		5 LEU A 120
GLY A 116
SER A 165
ILE A 245
ASP A 246
 None
 1.36A 6bxnB-2e3dA:
2.1		 6bxnB-2e3dA:
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.
2e3d UTP--GLUCOSE-1-PHOSP
HATE
URIDYLYLTRANSFERASE

(Escherichia
coli) 		PF00483
(NTP_transferase) 		5 LEU A 120
GLY A 116
VAL A 254
ILE A 245
ASP A 246
 None
 1.48A 6bxnB-2e3dA:
2.1		 6bxnB-2e3dA:
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.
2g16 GREEN FLUORESCENT
PROTEIN

(Aequorea
victoria) 		PF01353
(GFP) 		5 LEU B 137
GLY B 138
GLN B 177
ILE B 171
ASP B 173
 None
 1.20A 6bxnB-2g16B:
undetectable		 6bxnB-2g16B:
22.12
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.
2i44 SERINE-THREONINE
PHOSPHATASE 2C

(Toxoplasma
gondii) 		PF00481
(PP2C) 		5 LEU A 162
GLY A 163
HIS A 161
VAL A 204
ASP A 189
 None
 1.43A 6bxnB-2i44A:
undetectable		 6bxnB-2i44A:
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.
2j7n RNA-DEPENDENT RNA
POLYMERASE

(Neurospora
crassa) 		PF05183
(RdRP) 		5 LEU A 898
SER A 908
CYH A 903
ILE A1175
ASP A1176
 None
 1.15A 6bxnB-2j7nA:
undetectable		 6bxnB-2j7nA:
16.05
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.
2o2z HYPOTHETICAL PROTEIN

(Bacillus
halodurans) 		PF01933
(UPF0052) 		5 LEU A  93
GLY A  91
VAL A  35
ARG A  58
ASP A  56
 None
None
None
SO4  A 323 (-3.8A)
SO4  A 324 ( 4.6A)
 1.06A 6bxnB-2o2zA:
undetectable		 6bxnB-2o2zA:
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.
2ppv UNCHARACTERIZED
PROTEIN

(Staphylococcus
epidermidis) 		PF01933
(UPF0052) 		5 LEU A  92
GLY A  90
VAL A  35
ARG A  58
ILE A  57
 None
 1.34A 6bxnB-2ppvA:
undetectable		 6bxnB-2ppvA:
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.
2pt6 SPERMIDINE SYNTHASE

(Plasmodium
falciparum) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		5 GLY A 125
SER A  69
GLN A  72
ILE A 148
ASP A 178
 S4M  A 501 (-4.2A)
None
S4M  A 501 (-3.5A)
S4M  A 501 (-3.9A)
S4M  A 501 (-3.3A)
 1.21A 6bxnB-2pt6A:
3.6		 6bxnB-2pt6A:
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.
2qa2 POLYKETIDE OXYGENASE
CABE

(Streptomyces) 		PF01494
(FAD_binding_3) 		5 GLN A 293
VAL A 325
ARG A 390
ILE A 375
ASP A 374
 None
 1.33A 6bxnB-2qa2A:
undetectable		 6bxnB-2qa2A:
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.
2rb7 PEPTIDASE,
M20/M25/M40 FAMILY

(Desulfovibrio
alaskensis) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		5 GLY A   0
GLN A   5
VAL A  87
ILE A 340
ASP A  90
 None
 1.00A 6bxnB-2rb7A:
undetectable		 6bxnB-2rb7A:
22.86
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.
2v25 MAJOR CELL-BINDING
FACTOR

(Campylobacter
jejuni) 		PF00497
(SBP_bac_3) 		5 PHE A 171
LEU A 117
SER A 186
VAL A 182
ILE A 188
 None
 1.46A 6bxnB-2v25A:
3.1		 6bxnB-2v25A:
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.
2vc6 DIHYDRODIPICOLINATE
SYNTHASE

(Sinorhizobium
meliloti) 		PF00701
(DHDPS) 		5 PHE A   2
LEU A 183
GLY A 199
VAL A  39
ILE A   6
 None
 1.46A 6bxnB-2vc6A:
undetectable		 6bxnB-2vc6A:
24.16
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.
2vrk ALPHA-L-ARABINOFURAN
OSIDASE

(Thermobacillus
xylanilyticus) 		PF06964
(Alpha-L-AF_C) 		5 LEU A 330
GLY A 327
HIS A 331
VAL A 464
ILE A 320
 None
 1.36A 6bxnB-2vrkA:
undetectable		 6bxnB-2vrkA:
20.12
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.
2wlt L-ASPARAGINASE

(Helicobacter
pylori) 		PF00710
(Asparaginase) 		5 GLY A 151
HIS A 203
SER A 140
VAL A 188
ILE A 160
 None
 1.03A 6bxnB-2wltA:
undetectable		 6bxnB-2wltA:
22.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2xio PUTATIVE
DEOXYRIBONUCLEASE
TATDN1

(Homo sapiens) 		PF01026
(TatD_DNase) 		5 GLY A  82
GLN A 135
VAL A  74
CYH A  76
ASP A  56
 None
 1.36A 6bxnB-2xioA:
undetectable		 6bxnB-2xioA:
22.19
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.
2ynm LIGHT-INDEPENDENT
PROTOCHLOROPHYLLIDE
REDUCTASE SUBUNIT B

(Prochlorococcus
marinus) 		PF00148
(Oxidored_nitro)
PF08369
(PCP_red) 		5 PHE D 179
LEU D 224
GLY D 173
VAL D 398
CYH D 181
 None
 1.31A 6bxnB-2ynmD:
1.8		 6bxnB-2ynmD:
21.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2zsu SPERMIDINE SYNTHASE

(Pyrococcus
horikoshii) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		5 GLY A  85
SER A  29
GLN A  32
ILE A 108
ASP A 144
 AG3  A1001 ( 4.9A)
None
None
None
None
 1.24A 6bxnB-2zsuA:
2.7		 6bxnB-2zsuA:
21.89
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.
3ai5 YEAST ENHANCED GREEN
FLUORESCENT
PROTEIN,UBIQUITIN

(Aequorea
victoria;
Mus musculus) 		PF00240
(ubiquitin)
PF01353
(GFP) 		5 LEU A 137
GLY A 138
GLN A 177
ILE A 171
ASP A 173
 None
 1.15A 6bxnB-3ai5A:
undetectable		 6bxnB-3ai5A:
23.93
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.
3c6m SPERMINE SYNTHASE

(Homo sapiens) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		5 GLY A 199
SER A 145
GLN A 148
ILE A 221
ASP A 255
 MTA  A 401 (-3.9A)
None
MTA  A 401 (-3.5A)
MTA  A 401 (-3.8A)
MTA  A 401 (-3.6A)
 1.19A 6bxnB-3c6mA:
2.8		 6bxnB-3c6mA:
21.67
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.
3c8o REGULATOR OF
RIBONUCLEASE
ACTIVITY A

(Pseudomonas
aeruginosa) 		PF03737
(RraA-like) 		5 GLY A  66
SER A  46
LYS A 121
CYH A  41
ILE A  39
 None
PEG  A 186 (-3.8A)
EDO  A 174 (-3.7A)
None
None
 1.40A 6bxnB-3c8oA:
undetectable		 6bxnB-3c8oA:
23.27
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.
3cmm UBIQUITIN-ACTIVATING
ENZYME E1 1

(Saccharomyces
cerevisiae) 		PF00899
(ThiF)
PF09358
(E1_UFD)
PF10585
(UBA_e1_thiolCys)
PF16190
(E1_FCCH)
PF16191
(E1_4HB) 		5 LEU A 876
GLY A 875
VAL A 423
ILE A 359
ASP A 358
 None
 1.33A 6bxnB-3cmmA:
3.3		 6bxnB-3cmmA:
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.
3cp8 TRNA URIDINE
5-CARBOXYMETHYLAMINO
METHYL MODIFICATION
ENZYME GIDA

(Chlorobaculum
tepidum) 		PF01134
(GIDA)
PF13932
(GIDA_assoc) 		5 GLY A 254
GLN A 317
ARG A 257
ILE A 160
ASP A 163
 None
 1.34A 6bxnB-3cp8A:
3.1		 6bxnB-3cp8A:
20.81
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.
3czx PUTATIVE
N-ACETYLMURAMOYL-L-A
LANINE AMIDASE

(Neisseria
meningitidis) 		PF01520
(Amidase_3) 		5 GLY A  10
HIS A  11
SER A  70
VAL A  72
ILE A  74
 None
ZN  A 301 (-3.4A)
None
None
None
 1.25A 6bxnB-3czxA:
3.2		 6bxnB-3czxA:
20.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3dm0 MALTOSE-BINDING
PERIPLASMIC PROTEIN
FUSED WITH RACK1

(Escherichia
coli;
Arabidopsis
thaliana) 		PF00400
(WD40)
PF01547
(SBP_bac_1) 		5 SER A1122
LYS A1130
VAL A1108
ARG A1100
ASP A1084
 None
 1.47A 6bxnB-3dm0A:
undetectable		 6bxnB-3dm0A:
18.34
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.
3e4b ALGK

(Pseudomonas
fluorescens) 		no annotation 5 LEU A  41
GLY A  40
VAL A 180
ILE A 177
ASP A 176
 None
 1.25A 6bxnB-3e4bA:
undetectable		 6bxnB-3e4bA:
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.
3few COLICIN S4

(Escherichia
coli) 		PF01024
(Colicin) 		5 PHE X 486
LEU X 473
GLY X 471
VAL X 340
ILE X 314
 None
 1.27A 6bxnB-3fewX:
undetectable		 6bxnB-3fewX:
21.76
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.
3g7q VALINE-PYRUVATE
AMINOTRANSFERASE

(Salmonella
enterica) 		PF00155
(Aminotran_1_2) 		5 LEU A 376
GLY A 375
SER A 186
ILE A 138
ASP A 142
 None
 1.29A 6bxnB-3g7qA:
undetectable		 6bxnB-3g7qA:
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.
3gju PUTATIVE
AMINOTRANSFERASE

(Mesorhizobium
japonicum) 		PF00202
(Aminotran_3) 		5 LEU A 269
GLY A 270
SER A 293
ILE A 344
ASP A 345
 None
 1.27A 6bxnB-3gjuA:
undetectable		 6bxnB-3gjuA:
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.
3hjr EXTRACELLULAR SERINE
PROTEASE

(Aeromonas
sobria) 		PF00082
(Peptidase_S8)
PF01483
(P_proprotein) 		5 LEU A 316
GLY A 330
HIS A 317
GLN A  35
ILE A 122
 None
 1.34A 6bxnB-3hjrA:
2.4		 6bxnB-3hjrA:
18.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3lgg ADENOSINE DEAMINASE
CECR1

(Homo sapiens) 		PF00962
(A_deaminase)
PF08451
(A_deaminase_N) 		5 GLY A 357
HIS A 330
VAL A 432
ILE A 412
ASP A 428
 None
ZN  A 512 ( 3.5A)
None
None
None
 1.34A 6bxnB-3lggA:
undetectable		 6bxnB-3lggA:
19.31
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3lzd DPH2

(Pyrococcus
horikoshii) 		PF01866
(Diphthamide_syn) 		9 LEU A 161
GLY A 162
HIS A 184
SER A 236
LYS A 238
GLN A 241
VAL A 269
CYH A 287
ARG A 289
 SO4  A 344 (-3.8A)
SO4  A 344 (-3.5A)
SO4  A 344 (-4.2A)
None
None
SF4  A 343 ( 4.4A)
None
SF4  A 343 (-2.3A)
SO4  A 344 (-4.0A)
 0.61A 6bxnB-3lzdA:
20.3		 6bxnB-3lzdA:
38.44
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.
3ob8 BETA-GALACTOSIDASE

(Kluyveromyces
lactis) 		PF00703
(Glyco_hydro_2)
PF02836
(Glyco_hydro_2_C)
PF02837
(Glyco_hydro_2_N)
PF02929
(Bgal_small_N) 		5 LEU A 549
GLY A 579
VAL A 342
ILE A 347
ASP A 662
 None
 1.23A 6bxnB-3ob8A:
undetectable		 6bxnB-3ob8A:
16.03
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.
3opy 6-PHOSPHOFRUCTO-1-KI
NASE ALPHA-SUBUNIT
6-PHOSPHOFRUCTO-1-KI
NASE BETA-SUBUNIT

(Komagataella
pastoris;
Komagataella
pastoris) 		PF00365
(PFK)
PF00365
(PFK) 		5 LEU A 491
GLY A 492
VAL B 447
ARG B 460
ILE B 371
 None
None
None
SO4  B 943 (-3.7A)
None
 1.44A 6bxnB-3opyA:
4.4		 6bxnB-3opyA:
16.30
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.
3rw9 SPERMIDINE SYNTHASE

(Homo sapiens) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		5 GLY A 102
SER A  46
GLN A  49
ILE A 125
ASP A 155
 DSH  A 303 ( 4.7A)
None
DSH  A 303 (-3.6A)
DSH  A 303 (-3.8A)
DSH  A 303 (-3.5A)
 1.23A 6bxnB-3rw9A:
3.1		 6bxnB-3rw9A:
22.96
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.
3t1i DOUBLE-STRAND BREAK
REPAIR PROTEIN
MRE11A

(Homo sapiens) 		PF00149
(Metallophos)
PF04152
(Mre11_DNA_bind) 		5 LEU A 201
VAL A 241
ARG A 202
ILE A 238
ASP A 239
 None
 1.34A 6bxnB-3t1iA:
undetectable		 6bxnB-3t1iA:
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.
3v9e LACCASE

(Botrytis aclada) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		5 GLY A 271
HIS A  89
VAL A 250
ARG A 273
ASP A 275
 None
CU  A 603 (-2.9A)
None
None
None
 1.29A 6bxnB-3v9eA:
undetectable		 6bxnB-3v9eA:
18.32
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.
3v9e LACCASE

(Botrytis aclada) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		5 LEU A 486
HIS A 488
GLN A 107
VAL A  75
ILE A  86
 None
CU  A 602 (-3.1A)
None
None
None
 1.48A 6bxnB-3v9eA:
undetectable		 6bxnB-3v9eA:
18.32
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.
4b45 CELL DIVISION
PROTEIN FTSZ

(Haloferax
volcanii) 		PF00091
(Tubulin) 		5 GLY A  63
HIS A  62
VAL A  82
ILE A  54
ASP A  78
 None
 1.46A 6bxnB-4b45A:
2.8		 6bxnB-4b45A:
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.
4bhh NUCLEOPROTEIN

(California
encephalitis
orthobunyavirus) 		PF00952
(Bunya_nucleocap) 		5 GLY B 148
HIS B  93
SER B 205
VAL B 209
ILE B 163
 None
 1.34A 6bxnB-4bhhB:
undetectable		 6bxnB-4bhhB:
22.19
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.
4boo ACETYLCHOLINE
RECEPTOR SUBUNIT
ALPHA

(Torpedo
marmorata) 		PF02931
(Neur_chan_LBD)
PF02932
(Neur_chan_memb) 		5 LEU A  35
GLY A  34
VAL A 156
ILE A  31
ASP A  30
 None
 1.19A 6bxnB-4booA:
undetectable		 6bxnB-4booA:
20.64
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.
4c9m CYTOCHROME P450

(Novosphingobium
aromaticivorans) 		PF00067
(p450) 		5 LEU A 383
SER A 157
VAL A 159
ARG A 385
ILE A 140
 None
 1.45A 6bxnB-4c9mA:
undetectable		 6bxnB-4c9mA:
22.12
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.
4f40 PROSTAGLANDIN
F2-ALPHA
SYNTHASE/D-ARABINOSE
DEHYDROGENASE

(Leishmania
major) 		PF00248
(Aldo_ket_red) 		5 PHE A  75
LEU A  22
GLY A  23
VAL A   9
ILE A 236
 None
 1.25A 6bxnB-4f40A:
undetectable		 6bxnB-4f40A:
20.71
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.
4hp4 EAG-LIKE K[+]
CHANNEL

(Drosophila
melanogaster) 		PF13426
(PAS_9) 		5 LEU A  51
GLY A  47
LYS A  63
VAL A  42
CYH A  44
 None
None
MLY  A  62 ( 3.3A)
None
None
 1.43A 6bxnB-4hp4A:
undetectable		 6bxnB-4hp4A:
19.28
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.
4itu SHORT-CHAIN
DEHYDROGENASE/REDUCT
ASE SDR

(Xanthobacter
autotrophicus) 		PF13561
(adh_short_C2) 		5 LEU A 198
GLY A 195
VAL A 248
ILE A 226
ASP A 225
 None
NAI  A 301 ( 4.2A)
None
None
None
 1.38A 6bxnB-4ituA:
undetectable		 6bxnB-4ituA:
25.49
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.
4jgi PUTATIVE
UNCHARACTERIZED
PROTEIN

(Desulfitobacterium
hafniense) 		PF02310
(B12-binding)
PF02607
(B12-binding_2) 		5 PHE A 195
LEU A 146
GLY A 145
ILE A 205
ASP A 201
 None
None
COB  A 301 (-3.6A)
None
None
 1.24A 6bxnB-4jgiA:
5.6		 6bxnB-4jgiA:
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.
4k7k CATION EFFLUX SYSTEM
PROTEIN CUSC

(Escherichia
coli) 		PF02321
(OEP) 		5 LEU A 437
GLY A 440
HIS A 441
VAL A 152
ILE A  50
 None
 1.40A 6bxnB-4k7kA:
undetectable		 6bxnB-4k7kA:
22.00
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.
4kys THIAMINE
PYRIDINYLASE I

(Clostridium
botulinum) 		PF01547
(SBP_bac_1) 		5 LEU A 179
GLY A 263
VAL A 159
ILE A 156
ASP A 155
 None
 1.27A 6bxnB-4kysA:
undetectable		 6bxnB-4kysA:
22.07
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.
4lx4 ENDOGLUCANASE(ENDO-1
,4-BETA-GLUCANASE)PR
OTEIN

(Pseudomonas
stutzeri) 		PF00150
(Cellulase) 		5 LEU A 250
GLY A 251
HIS A 206
ARG A  56
ILE A  55
 None
None
TRS  A 401 ( 4.8A)
TRS  A 401 ( 4.6A)
None
 1.41A 6bxnB-4lx4A:
undetectable		 6bxnB-4lx4A:
22.58
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.
4nhy 2-OXOGLUTARATE AND
IRON-DEPENDENT
OXYGENASE
DOMAIN-CONTAINING
PROTEIN 1

(Homo sapiens) 		PF10637
(Ofd1_CTDD)
PF13661
(2OG-FeII_Oxy_4) 		5 LEU A  79
GLY A  78
HIS A 111
SER A 229
LYS A 145
 None
 1.40A 6bxnB-4nhyA:
undetectable		 6bxnB-4nhyA:
18.44
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.
4ny4 CYTOCHROME P450 3A4

(Homo sapiens) 		PF00067
(p450) 		5 PHE A  60
LEU A 479
GLY A 480
ILE A  50
ASP A  76
 None
 1.35A 6bxnB-4ny4A:
undetectable		 6bxnB-4ny4A:
20.74
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.
4pxd ALLANTOATE
AMIDOHYDROLASE

(Escherichia
coli) 		PF01546
(Peptidase_M20) 		5 LEU A 189
GLY A  96
GLN A 193
VAL A  85
ASP A  83
 None
None
1AL  A 502 ( 3.2A)
None
None
 1.39A 6bxnB-4pxdA:
undetectable		 6bxnB-4pxdA:
22.27
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.
4rjk ACETOLACTATE
SYNTHASE

(Bacillus
subtilis) 		PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N) 		5 LEU A 126
GLY A  86
VAL A  44
ILE A  41
ASP A  42
 None
 1.30A 6bxnB-4rjkA:
undetectable		 6bxnB-4rjkA:
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.
4tvc DEXTRANSUCRASE

(Leuconostoc
mesenteroides) 		PF02324
(Glyco_hydro_70) 		5 PHE A2525
LEU A2472
GLY A2540
VAL A2552
ARG A2539
 None
 1.34A 6bxnB-4tvcA:
undetectable		 6bxnB-4tvcA:
14.36
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.
4uoe SPERMIDINE SYNTHASE

(Plasmodium
falciparum) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		5 GLY A 125
SER A  69
GLN A  72
ILE A 148
ASP A 178
 MTA  A 401 (-3.8A)
None
MTA  A 401 (-3.3A)
MTA  A 401 (-3.8A)
MTA  A 401 (-3.2A)
 1.32A 6bxnB-4uoeA:
2.3		 6bxnB-4uoeA:
21.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4v0k ARF-LIKE SMALL
GTPASE

(Chlamydomonas
reinhardtii) 		PF00025
(Arf) 		5 PHE A 126
LEU A 163
VAL A  22
ARG A  36
ILE A  34
 None
GDP  A 700 (-4.4A)
None
None
None
 1.39A 6bxnB-4v0kA:
undetectable		 6bxnB-4v0kA:
18.71
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.
4v2x ENDO-BETA-1,4-GLUCAN
ASE (CELLULASE B)

(Bacillus
halodurans) 		PF00150
(Cellulase)
PF03442
(CBM_X2) 		5 LEU A 294
GLY A 295
HIS A 249
ARG A  84
ILE A  83
 None
 1.35A 6bxnB-4v2xA:
undetectable		 6bxnB-4v2xA:
20.63
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.
4w7v CELLULASE

(Xanthomonas
citri) 		PF00150
(Cellulase) 		5 LEU A 244
GLY A 245
HIS A 204
ARG A  47
ILE A  46
 None
 1.32A 6bxnB-4w7vA:
undetectable		 6bxnB-4w7vA:
21.95
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.
4wgx MOLINATE HYDROLASE

(Gulosibacter
molinativorax) 		PF01979
(Amidohydro_1) 		5 LEU A 117
GLY A 141
VAL A 238
CYH A 208
ILE A 210
 None
 1.46A 6bxnB-4wgxA:
undetectable		 6bxnB-4wgxA:
21.89
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.
4wjs RSA4

(Chaetomium
thermophilum) 		PF00400
(WD40) 		5 SER A 421
LYS A 429
VAL A 407
ARG A 399
ASP A 381
 None
 1.10A 6bxnB-4wjsA:
undetectable		 6bxnB-4wjsA:
22.27
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.
4xi2 TYROSINE-PROTEIN
KINASE BTK

(Mus musculus) 		PF00017
(SH2)
PF00018
(SH3_1)
PF07714
(Pkinase_Tyr) 		5 LEU A 542
GLY A 541
SER A 564
VAL A 568
ARG A 544
 None
 1.35A 6bxnB-4xi2A:
undetectable		 6bxnB-4xi2A:
20.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4z4m GREEN FLUORESCENT
PROTEIN,TAX1-BINDING
PROTEIN 1

(Aequorea
victoria;
Homo sapiens) 		PF01353
(GFP) 		5 LEU A 137
GLY A 138
GLN A 177
ILE A 171
ASP A 173
 None
 1.13A 6bxnB-4z4mA:
undetectable		 6bxnB-4z4mA:
23.73
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.
5e0c CELLULASE

(Bacillus sp.
BG-CS10) 		PF00150
(Cellulase)
PF03442
(CBM_X2) 		5 LEU A 269
GLY A 270
HIS A 224
ARG A  59
ILE A  58
 None
 1.33A 6bxnB-5e0cA:
undetectable		 6bxnB-5e0cA:
19.34
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.
5ej1 PUTATIVE CELLULOSE
SYNTHASE

(Rhodobacter
sphaeroides) 		PF00535
(Glycos_transf_2)
PF03552
(Cellulose_synt)
PF07238
(PilZ) 		5 PHE A 317
LEU A 309
GLY A 314
GLN A 273
VAL A 323
 None
 1.27A 6bxnB-5ej1A:
2.3		 6bxnB-5ej1A:
17.69
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.
5idj CELL CYCLE HISTIDINE
KINASE CCKA

(Caulobacter
vibrioides) 		PF00512
(HisKA)
PF02518
(HATPase_c) 		5 PHE A 536
LEU A 463
GLY A 464
VAL A 513
ILE A 524
 ADP  A 600 (-4.5A)
None
None
None
None
 1.32A 6bxnB-5idjA:
undetectable		 6bxnB-5idjA:
21.78
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.
5j3p TYROSYL-DNA
PHOSPHODIESTERASE 2

(Homo sapiens) 		PF03372
(Exo_endo_phos) 		5 LEU A 354
GLY A 353
GLN A 151
VAL A 153
ILE A 121
 None
 1.46A 6bxnB-5j3pA:
undetectable		 6bxnB-5j3pA:
21.93
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.
5ksd ATPASE 2, PLASMA
MEMBRANE-TYPE

(Arabidopsis
thaliana) 		PF00122
(E1-E2_ATPase)
PF00690
(Cation_ATPase_N)
PF00702
(Hydrolase) 		5 SER A 691
LYS A 692
VAL A 292
ILE A 687
ASP A 684
 None
 1.42A 6bxnB-5ksdA:
undetectable		 6bxnB-5ksdA:
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.
5liy ALDO-KETO REDUCTASE
FAMILY 1 MEMBER B10

(Homo sapiens) 		PF00248
(Aldo_ket_red) 		5 PHE X  74
LEU X  18
GLY X  19
VAL X   5
ILE X 259
 None
None
NAP  X 401 (-3.4A)
None
None
 1.22A 6bxnB-5liyX:
undetectable		 6bxnB-5liyX:
24.00
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.
5mov CASEIN KINASE II
SUBUNIT ALPHA

(Homo sapiens) 		PF00069
(Pkinase) 		5 PHE A 232
GLY A 235
HIS A 236
ARG A 244
ILE A 245
 None
 1.33A 6bxnB-5movA:
undetectable		 6bxnB-5movA:
21.49
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.
5nag KYNURENINE
3-MONOOXYGENASE

(Pseudomonas
fluorescens) 		PF01494
(FAD_binding_3) 		5 LEU A 309
GLY A 310
VAL A 407
CYH A 326
ILE A 362
 None
FAD  A 501 (-3.4A)
None
None
None
 1.34A 6bxnB-5nagA:
1.8		 6bxnB-5nagA:
19.06
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.
5nd1 CAPSID PROTEIN

(Rosellinia
necatrix
quadrivirus 1) 		no annotation 5 PHE B 824
LEU B 120
VAL B 857
CYH B 827
ILE B 101
 None
 1.24A 6bxnB-5nd1B:
undetectable		 6bxnB-5nd1B:
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.
5o7g ALPHA/BETA HYDROLASE
FAMILY PROTEIN

(Bacillus
coagulans) 		no annotation 5 LEU A 134
GLY A 133
GLN A  33
VAL A  99
ILE A  31
 None
 1.05A 6bxnB-5o7gA:
2.0		 6bxnB-5o7gA:
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.
5vvh OCTOPINE
CATABOLISM/UPTAKE
OPERON REGULATORY
PROTEIN OCCR

(Agrobacterium
tumefaciens) 		PF03466
(LysR_substrate) 		5 LEU A 227
GLY A 233
GLN A 193
VAL A 203
ILE A 236
 None
 1.47A 6bxnB-5vvhA:
2.3		 6bxnB-5vvhA:
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.
5wrj PROTEIN-TYROSINE
SULFOTRANSFERASE 1

(Homo sapiens) 		PF13469
(Sulfotransfer_3) 		5 GLY A  98
HIS A 149
SER A 264
ARG A  96
ILE A  95
 None
 1.43A 6bxnB-5wrjA:
undetectable		 6bxnB-5wrjA:
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.
5xgv PYRE3

(Streptomyces
rugosporus) 		no annotation 5 PHE A  54
LEU A 396
GLY A 440
VAL A  13
ARG A 377
 None
None
None
FAD  A 501 (-3.7A)
None
 1.45A 6bxnB-5xgvA:
2.4		 6bxnB-5xgvA:
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.
5z7h LYSR FAMILY
TRANSCRIPTIONAL
REGULATOR

(Staphylococcus
aureus) 		no annotation 5 LEU A 177
GLY A 225
SER A 238
GLN A 241
ILE A 221
 None
 1.17A 6bxnB-5z7hA:
3.2		 6bxnB-5z7hA:
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.
6aqj KETOL-ACID
REDUCTOISOMERASE
(NADP(+))

(Staphylococcus
aureus) 		no annotation 5 PHE A 140
LEU A 135
GLY A 133
HIS A 134
ILE A 171
 None
GOL  A 404 ( 4.4A)
NDP  A 407 (-3.9A)
GOL  A 405 (-4.1A)
None
 1.38A 6bxnB-6aqjA:
2.5		 6bxnB-6aqjA:
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.
6bxn DIPHTHAMIDE
BIOSYNTHESIS ENZYME
DPH2

(Candidatus
Methanoperedens
nitroreducens) 		no annotation 12 PHE A  58
LEU A 157
GLY A 158
HIS A 180
SER A 232
LYS A 234
GLN A 237
VAL A 265
CYH A 283
ARG A 285
ILE A 286
ASP A 290
 SAM  A 901 ( 3.5A)
SAM  A 901 (-3.8A)
SF4  A 900 ( 3.6A)
SAM  A 901 (-4.2A)
SAM  A 901 ( 3.9A)
SAM  A 901 (-4.9A)
SAM  A 901 (-3.0A)
SAM  A 901 (-4.0A)
SF4  A 900 ( 2.2A)
SAM  A 901 (-4.1A)
SAM  A 901 (-4.7A)
SAM  A 901 (-3.2A)
 0.18A 6bxnB-6bxnA:
43.0		 6bxnB-6bxnA:
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.
6cnk IGG1 HEAVY CHAIN

(Mus musculus) 		no annotation 5 GLY G  43
HIS G  44
VAL G 118
ARG G  41
ASP G  91
 None
 1.31A 6bxnB-6cnkG:
undetectable		 6bxnB-6cnkG:
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.
6esd FLAVIN-DEPENDENT
L-TRYPTOPHAN OXIDASE
VIOA

(Chromobacterium
violaceum) 		no annotation 5 LEU B 403
GLY B 401
SER B 378
CYH B 387
ILE B 238
 None
FAD  B 501 ( 4.6A)
None
None
None
 1.35A 6bxnB-6esdB:
2.5		 6bxnB-6esdB:
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.
6etz BETA-GALACTOSIDASE

(Arthrobacter
sp. 32cB) 		no annotation 5 LEU A 515
GLY A 545
VAL A 321
ILE A 326
ASP A 625
 None
 1.13A 6bxnB-6etzA:
undetectable		 6bxnB-6etzA:
undetectable