SIMILAR PATTERNS OF AMINO ACIDS FOR 1GTI_B_CCSB47

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.
1gm5 RECG

(Thermotoga
maritima) 		PF00270
(DEAD)
PF00271
(Helicase_C)
PF17190
(RecG_N)
PF17191
(RecG_wedge) 		4 THR A 313
LEU A 317
GLY A 307
LEU A 299
 None
 0.94A 1gtiB-1gm5A:
undetectable		 1gtiB-1gm5A:
13.72
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.
1iuf CENTROMERE ABP1
PROTEIN

(Schizosaccharomyces
pombe) 		PF03221
(HTH_Tnp_Tc5) 		4 LEU A  33
GLY A  29
LEU A  24
TYR A  20
 None
 0.82A 1gtiB-1iufA:
undetectable		 1gtiB-1iufA:
20.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1jmy BILE-SALT-ACTIVATED
LIPASE

(Homo sapiens) 		PF00135
(COesterase) 		4 LEU A  65
THR A 267
LEU A 151
GLY A 149
 None
 0.94A 1gtiB-1jmyA:
undetectable		 1gtiB-1jmyA:
16.83
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.
1jsd HAEMAGGLUTININ (HA1
CHAIN)

(Influenza A
virus) 		PF00509
(Hemagglutinin) 		4 LEU A 184
THR A 145
LEU A 241
GLY A 239
 None
 0.90A 1gtiB-1jsdA:
0.0		 1gtiB-1jsdA:
20.31
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1lbk GLUTATHIONE
S-TRANSFERASE CLASS
PI CHIMAERA (CODA)

(Homo sapiens) 		PF02798
(GST_N)
PF14497
(GST_C_3) 		4 LEU A  43
LEU A  48
GLY A  50
TYR A  63
 None
 0.71A 1gtiB-1lbkA:
33.4		 1gtiB-1lbkA:
82.21
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1lbk GLUTATHIONE
S-TRANSFERASE CLASS
PI CHIMAERA (CODA)

(Homo sapiens) 		PF02798
(GST_N)
PF14497
(GST_C_3) 		5 TRP A  38
LEU A  48
GLY A  50
LEU A  52
TYR A  63
 GSH  A 504 (-3.9A)
None
None
GSH  A 504 (-4.7A)
None
 0.27A 1gtiB-1lbkA:
33.4		 1gtiB-1lbkA:
82.21
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.
1ocs SORTING NEXIN GRD19

(Saccharomyces
cerevisiae) 		PF00787
(PX) 		4 LEU A  68
LEU A 143
GLY A 147
LEU A 151
 None
 0.91A 1gtiB-1ocsA:
0.0		 1gtiB-1ocsA:
22.60
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.
1or7 RNA POLYMERASE
SIGMA-E FACTOR
SIGMA-E FACTOR
NEGATIVE REGULATORY
PROTEIN

(Escherichia
coli;
Escherichia
coli) 		PF04542
(Sigma70_r2)
PF08281
(Sigma70_r4_2)
PF03872
(RseA_N) 		4 TRP C  33
THR C  14
LEU A   5
LEU A  10
 None
 0.82A 1gtiB-1or7C:
undetectable		 1gtiB-1or7C:
16.58
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.
1ovm INDOLE-3-PYRUVATE
DECARBOXYLASE

(Enterobacter
cloacae) 		PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N) 		4 LEU A 291
THR A 288
GLY A 294
LEU A 542
 None
 0.79A 1gtiB-1ovmA:
0.4		 1gtiB-1ovmA:
17.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1pww LETHAL FACTOR

(Bacillus
anthracis) 		PF07737
(ATLF)
PF09156
(Anthrax-tox_M) 		4 LEU A 505
THR A 509
GLY A 428
TYR A 278
 None
 0.90A 1gtiB-1pwwA:
0.0		 1gtiB-1pwwA:
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.
1u0n PLATELET
GLYCOPROTEIN IB

(Homo sapiens) 		PF01462
(LRRNT)
PF13855
(LRR_8) 		4 LEU D 144
THR D 147
GLY D 170
LEU D 168
 None
 0.91A 1gtiB-1u0nD:
undetectable		 1gtiB-1u0nD:
23.64
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.
1us4 PUTATIVE GLUR0
LIGAND BINDING CORE

(Thermus
thermophilus) 		PF16868
(NMT1_3) 		4 LEU A 256
THR A 260
GLY A 302
LEU A 105
 None
 0.70A 1gtiB-1us4A:
undetectable		 1gtiB-1us4A:
20.56
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.
1vi1 FATTY
ACID/PHOSPHOLIPID
SYNTHESIS PROTEIN
PLSX

(Bacillus
subtilis) 		PF02504
(FA_synthesis) 		4 THR A 234
LEU A 232
GLY A 228
LEU A 176
 None
 0.92A 1gtiB-1vi1A:
undetectable		 1gtiB-1vi1A:
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.
1wa3 2-KETO-3-DEOXY-6-PHO
SPHOGLUCONATE
ALDOLASE

(Thermotoga
maritima) 		PF01081
(Aldolase) 		4 LEU A  16
THR A  42
GLY A  66
LEU A  55
 None
 0.94A 1gtiB-1wa3A:
undetectable		 1gtiB-1wa3A:
22.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1wkr POLYPOROPEPSIN

(Irpex lacteus) 		PF00026
(Asp) 		4 LEU A 105
THR A  38
GLY A 108
LEU A 143
 None
 0.84A 1gtiB-1wkrA:
undetectable		 1gtiB-1wkrA:
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.
1y79 PEPTIDYL-DIPEPTIDASE
DCP

(Escherichia
coli) 		PF01432
(Peptidase_M3) 		4 LEU 1 221
THR 1 223
GLY 1 245
LEU 1 241
 None
 0.78A 1gtiB-1y791:
2.3		 1gtiB-1y791:
14.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2aml SIS DOMAIN PROTEIN

(Listeria
monocytogenes) 		PF01380
(SIS) 		4 TRP A  41
LEU A 160
GLY A 162
LEU A  30
 None
 0.93A 1gtiB-2amlA:
undetectable		 1gtiB-2amlA:
20.44
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.
2ddh ACYL-COA OXIDASE

(Rattus
norvegicus) 		PF01756
(ACOX)
PF02770
(Acyl-CoA_dh_M)
PF14749
(Acyl-CoA_ox_N) 		4 THR A 110
LEU A 108
GLY A 105
LEU A 102
 None
None
None
FAD  A 699 (-4.4A)
 0.94A 1gtiB-2ddhA:
undetectable		 1gtiB-2ddhA:
16.04
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2gsr CLASS PI GST
GLUTATHIONE
S-TRANSFERASE

(Sus scrofa) 		PF02798
(GST_N)
PF14497
(GST_C_3) 		4 TRP A  38
LEU A  46
LEU A  50
TYR A  61
 GTS  A 208 (-3.9A)
None
GTS  A 208 (-4.8A)
None
 0.38A 1gtiB-2gsrA:
34.9		 1gtiB-2gsrA:
84.69
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.
2nz9 BOTULINUM NEUROTOXIN
TYPE A

(Clostridium
botulinum) 		PF01742
(Peptidase_M27)
PF07951
(Toxin_R_bind_C)
PF07952
(Toxin_trans)
PF07953
(Toxin_R_bind_N) 		4 THR A 109
LEU A 107
GLY A 104
TYR A 349
 None
 0.93A 1gtiB-2nz9A:
undetectable		 1gtiB-2nz9A:
9.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2qsr TRANSCRIPTION-REPAIR
COUPLING FACTOR

(Streptococcus
pneumoniae) 		PF03461
(TRCF) 		4 LEU A1151
LEU A1071
GLY A1074
TYR A1049
 None
 0.89A 1gtiB-2qsrA:
undetectable		 1gtiB-2qsrA:
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.
2r4j AEROBIC
GLYCEROL-3-PHOSPHATE
DEHYDROGENASE

(Escherichia
coli) 		PF01266
(DAO)
PF16901
(DAO_C) 		4 LEU A  37
THR A 168
LEU A  32
GLY A  10
 None
None
None
FAD  A 600 ( 3.7A)
 0.89A 1gtiB-2r4jA:
undetectable		 1gtiB-2r4jA:
18.39
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.
2rgj FLAVIN-CONTAINING
MONOOXYGENASE

(Pseudomonas
aeruginosa) 		PF01494
(FAD_binding_3) 		4 THR A 128
LEU A  34
GLY A  11
LEU A  17
 None
None
FAD  A 403 (-3.2A)
None
 0.90A 1gtiB-2rgjA:
undetectable		 1gtiB-2rgjA:
20.35
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.
2wrd HEMAGGLUTININ

(Influenza A
virus) 		PF00509
(Hemagglutinin) 		4 LEU A 193
THR A 154
LEU A 250
GLY A 248
 None
 0.71A 1gtiB-2wrdA:
undetectable		 1gtiB-2wrdA:
18.45
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.
2ww9 SEC SIXTY-ONE
PROTEIN HOMOLOG

(Saccharomyces
cerevisiae) 		PF00344
(SecY)
PF10559
(Plug_translocon) 		4 THR A 164
GLY A 159
LEU A 157
TYR A 128
 None
 0.87A 1gtiB-2ww9A:
undetectable		 1gtiB-2ww9A:
17.05
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.
2yik ENDOGLUCANASE

(Ruminiclostridium
thermocellum) 		PF00759
(Glyco_hydro_9) 		4 LEU A 434
LEU A 428
GLY A 430
TYR A 427
 None
 0.93A 1gtiB-2yikA:
2.2		 1gtiB-2yikA:
16.07
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.
2yp2 HEMAGGLUTININ

(Influenza A
virus) 		PF00509
(Hemagglutinin) 		4 LEU A 194
THR A 155
LEU A 251
GLY A 249
 None
 0.91A 1gtiB-2yp2A:
undetectable		 1gtiB-2yp2A:
17.86
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.
2yqu 2-OXOGLUTARATE
DEHYDROGENASE E3
COMPONENT

(Thermus
thermophilus) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		4 THR A 227
LEU A 196
GLY A 174
LEU A 180
 None
 0.79A 1gtiB-2yquA:
undetectable		 1gtiB-2yquA:
17.90
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.
2yw4 4-HYDROXY-2-OXOGLUTA
RATE
ALDOLASE/2-DEYDRO-3-
DEOXYPHOSPHOGLUCONAT
E ALDOLASE

(Thermus
thermophilus) 		PF01081
(Aldolase) 		4 LEU A  34
LEU A  64
GLY A  62
LEU A  58
 None
 0.86A 1gtiB-2yw4A:
undetectable		 1gtiB-2yw4A:
25.79
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.
2zg6 PUTATIVE
UNCHARACTERIZED
PROTEIN ST2620

(Sulfurisphaera
tokodaii) 		PF13419
(HAD_2) 		4 LEU A  14
THR A  13
GLY A  16
LEU A  96
 None
 0.92A 1gtiB-2zg6A:
undetectable		 1gtiB-2zg6A:
24.08
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.
3a74 LYSYL-TRNA
SYNTHETASE

(Geobacillus
stearothermophilus) 		PF00152
(tRNA-synt_2)
PF01336
(tRNA_anti-codon) 		4 LEU A 188
GLY A 192
LEU A 194
TYR A 246
 None
 0.91A 1gtiB-3a74A:
undetectable		 1gtiB-3a74A:
16.53
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.
3brk GLUCOSE-1-PHOSPHATE
ADENYLYLTRANSFERASE

(Agrobacterium
tumefaciens) 		PF00483
(NTP_transferase) 		4 THR X  66
LEU X  18
GLY X 134
LEU X  51
 None
 0.90A 1gtiB-3brkX:
undetectable		 1gtiB-3brkX:
19.71
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.
3cwg SIGNAL TRANSDUCER
AND ACTIVATOR OF
TRANSCRIPTION 3

(Mus musculus) 		PF00017
(SH2)
PF01017
(STAT_alpha)
PF02864
(STAT_bind) 		4 LEU A 607
THR A 622
LEU A 670
LEU A 673
 None
 0.94A 1gtiB-3cwgA:
4.5		 1gtiB-3cwgA:
17.29
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.
3d3a BETA-GALACTOSIDASE

(Bacteroides
thetaiotaomicron) 		PF01301
(Glyco_hydro_35) 		4 LEU A 461
THR A 409
GLY A 458
LEU A 455
 None
 0.84A 1gtiB-3d3aA:
undetectable		 1gtiB-3d3aA:
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.
3dan CYTOCHROME P450 74A2

(Parthenium
argentatum) 		PF00067
(p450) 		4 THR A 288
GLY A 293
LEU A 299
TYR A 392
 None
 0.86A 1gtiB-3danA:
undetectable		 1gtiB-3danA:
18.50
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.
3ewm UNCHARACTERIZED
SUGAR KINASE PH1459

(Pyrococcus
horikoshii) 		PF00294
(PfkB) 		4 LEU A 263
LEU A 258
GLY A 256
LEU A 253
 None
 0.93A 1gtiB-3ewmA:
undetectable		 1gtiB-3ewmA:
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.
3eyk HEMAGGLUTININ HA1
CHAIN

(Influenza A
virus) 		PF00509
(Hemagglutinin) 		4 LEU A 196
THR A 155
LEU A 253
GLY A 251
 None
 0.74A 1gtiB-3eykA:
undetectable		 1gtiB-3eykA:
21.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3hrx PROBABLE ENOYL-COA
HYDRATASE

(Thermus
thermophilus) 		PF00378
(ECH_1) 		5 LEU A  28
THR A  25
GLY A  60
LEU A 109
TYR A  80
 None
 1.40A 1gtiB-3hrxA:
undetectable		 1gtiB-3hrxA:
23.17
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.
3hrx PROBABLE ENOYL-COA
HYDRATASE

(Thermus
thermophilus) 		PF00378
(ECH_1) 		4 LEU A  50
LEU A 111
GLY A 113
LEU A  87
 None
 0.86A 1gtiB-3hrxA:
undetectable		 1gtiB-3hrxA:
23.17
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.
3iha SALT-TOLERANT
GLUTAMINASE

(Micrococcus
luteus) 		PF04960
(Glutaminase) 		4 LEU A 211
LEU A 269
GLY A 274
LEU A 266
 None
 0.79A 1gtiB-3ihaA:
undetectable		 1gtiB-3ihaA:
18.12
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.
3iuk UNCHARACTERIZED
PROTEIN

(Paenarthrobacter
aurescens) 		PF05960
(DUF885) 		4 LEU A  88
THR A  60
LEU A  62
LEU A  67
 None
 0.87A 1gtiB-3iukA:
undetectable		 1gtiB-3iukA:
15.86
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.
3l9r CD1B3

(Bos taurus) 		PF07654
(C1-set)
PF16497
(MHC_I_3) 		5 LEU A 161
THR A 165
LEU A 170
GLY A 101
LEU A  12
 None
None
None
None
L9R  A 284 ( 4.1A)
 1.30A 1gtiB-3l9rA:
undetectable		 1gtiB-3l9rA:
19.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3lxd FAD-DEPENDENT
PYRIDINE
NUCLEOTIDE-DISULPHID
E OXIDOREDUCTASE

(Novosphingobium
aromaticivorans) 		PF07992
(Pyr_redox_2)
PF14759
(Reductase_C) 		4 THR A 213
LEU A 181
GLY A 159
LEU A 165
 None
 0.87A 1gtiB-3lxdA:
undetectable		 1gtiB-3lxdA:
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.
3mvu TENA FAMILY
TRANSCRIPTIONAL
REGULATOR

(Ruegeria sp.
TM1040) 		PF03070
(TENA_THI-4) 		4 THR A 212
LEU A 214
GLY A 217
TYR A 117
 None
EDO  A 230 ( 4.4A)
None
None
 0.90A 1gtiB-3mvuA:
undetectable		 1gtiB-3mvuA:
21.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3mzn GLUCARATE
DEHYDRATASE

(Chromohalobacter
salexigens) 		PF13378
(MR_MLE_C) 		4 LEU A  21
LEU A  23
GLY A 204
LEU A 207
 None
 0.93A 1gtiB-3mznA:
undetectable		 1gtiB-3mznA:
18.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3n2t PUTATIVE
OXIDOREDUCTASE

(Gluconobacter
oxydans) 		PF00248
(Aldo_ket_red) 		4 TRP A  23
LEU A 183
GLY A 209
LEU A 281
 None
 0.85A 1gtiB-3n2tA:
undetectable		 1gtiB-3n2tA:
19.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3nnd POSSIBLE SUBSTRATE
BINDING PROTEIN OF
ABC TRANSPORTER
SYSTEM

(Rhodopseudomonas
palustris) 		no annotation 4 TRP B 278
THR B 295
LEU B  38
GLY B  41
 None
 0.78A 1gtiB-3nndB:
undetectable		 1gtiB-3nndB:
19.51
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.
3nrn UNCHARACTERIZED
PROTEIN PF1083

(Pyrococcus
furiosus) 		PF01593
(Amino_oxidase) 		4 THR A 208
LEU A  29
GLY A   7
LEU A  13
 None
None
AMP  A 422 (-3.2A)
None
 0.79A 1gtiB-3nrnA:
undetectable		 1gtiB-3nrnA:
21.64
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3o76 GLUTATHIONE
S-TRANSFERASE P 1

(Mus musculus) 		PF02798
(GST_N)
PF14497
(GST_C_3) 		5 LEU A  43
THR A  46
LEU A  48
GLY A  50
TYR A  63
 None
 0.68A 1gtiB-3o76A:
35.0		 1gtiB-3o76A:
99.52
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3o76 GLUTATHIONE
S-TRANSFERASE P 1

(Mus musculus) 		PF02798
(GST_N)
PF14497
(GST_C_3) 		5 THR A  46
LEU A  48
GLY A  50
LEU A  52
TYR A  63
 None
None
None
GTB  A 210 (-4.9A)
None
 0.43A 1gtiB-3o76A:
35.0		 1gtiB-3o76A:
99.52
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3o76 GLUTATHIONE
S-TRANSFERASE P 1

(Mus musculus) 		PF02798
(GST_N)
PF14497
(GST_C_3) 		5 TRP A  38
LEU A  43
LEU A  48
GLY A  50
TYR A  63
 GTB  A 210 (-4.0A)
None
None
None
None
 0.84A 1gtiB-3o76A:
35.0		 1gtiB-3o76A:
99.52
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3o76 GLUTATHIONE
S-TRANSFERASE P 1

(Mus musculus) 		PF02798
(GST_N)
PF14497
(GST_C_3) 		5 TRP A  38
LEU A  48
GLY A  50
LEU A  52
TYR A  63
 GTB  A 210 (-4.0A)
None
None
GTB  A 210 (-4.9A)
None
 0.39A 1gtiB-3o76A:
35.0		 1gtiB-3o76A:
99.52
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.
3p54 ENVELOPE
GLYCOPROTEIN

(Japanese
encephalitis
virus) 		PF00869
(Flavi_glycoprot)
PF02832
(Flavi_glycop_C) 		4 LEU A 285
GLY A 283
LEU A 280
TYR A 137
 None
 0.94A 1gtiB-3p54A:
undetectable		 1gtiB-3p54A:
20.05
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.
3qqi HEMAGGLUTININ

(Influenza A
virus) 		PF00509
(Hemagglutinin) 		4 LEU A 194
THR A 155
LEU A 251
GLY A 249
 None
EPE  A3380 ( 3.7A)
None
None
 0.81A 1gtiB-3qqiA:
undetectable		 1gtiB-3qqiA:
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.
3ugv ENOLASE

(alpha
proteobacterium
BAL199) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		4 LEU A  79
THR A  42
GLY A  76
LEU A  74
 None
 0.89A 1gtiB-3ugvA:
undetectable		 1gtiB-3ugvA:
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.
4c3y 3-KETOSTEROID
DEHYDROGENASE

(Rhodococcus
erythropolis) 		PF00890
(FAD_binding_2) 		4 THR A 191
LEU A  36
GLY A  14
LEU A  20
 None
None
FAD  A 551 (-3.3A)
None
 0.81A 1gtiB-4c3yA:
undetectable		 1gtiB-4c3yA:
17.51
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.
4ecl SERINE RACEMASE

(Enterococcus
faecalis) 		PF00842
(Ala_racemase_C)
PF01168
(Ala_racemase_N) 		4 LEU A 239
LEU A 224
GLY A 226
LEU A 228
 None
 0.93A 1gtiB-4eclA:
undetectable		 1gtiB-4eclA:
21.26
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.
4f3n UNCHARACTERIZED ACR,
COG1565 SUPERFAMILY

(Burkholderia
thailandensis) 		PF02636
(Methyltransf_28) 		5 LEU A 103
LEU A 134
GLY A 132
LEU A 129
TYR A 147
 None
 1.37A 1gtiB-4f3nA:
undetectable		 1gtiB-4f3nA:
18.69
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.
4hfu HEMAGGLUTININ HA1

(Influenza A
virus) 		PF00509
(Hemagglutinin) 		4 LEU A 194
THR A 155
LEU A 251
GLY A 249
 None
 0.90A 1gtiB-4hfuA:
undetectable		 1gtiB-4hfuA:
19.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4hkx HEMAGGLUTININ HA1

(Influenza A
virus) 		PF00509
(Hemagglutinin) 		4 LEU E 194
THR E 155
LEU E 251
GLY E 249
 None
 0.87A 1gtiB-4hkxE:
undetectable		 1gtiB-4hkxE:
23.92
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.
4jug HEMAGGLUTININ

(Influenza A
virus) 		PF00509
(Hemagglutinin) 		4 LEU A 194
THR A 155
LEU A 251
GLY A 249
 None
 0.93A 1gtiB-4jugA:
undetectable		 1gtiB-4jugA:
20.06
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.
4k17 LEUCINE-RICH
REPEAT-CONTAINING
PROTEIN 16A

(Mus musculus) 		PF13516
(LRR_6) 		4 LEU A 394
LEU A 387
GLY A 389
LEU A 361
 None
 0.82A 1gtiB-4k17A:
undetectable		 1gtiB-4k17A:
17.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4k6j WINGS APART-LIKE
PROTEIN HOMOLOG

(Homo sapiens) 		PF07814
(WAPL) 		4 LEU A1036
THR A1125
LEU A1127
GLY A1130
 None
 0.81A 1gtiB-4k6jA:
2.6		 1gtiB-4k6jA:
16.34
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.
4k6j WINGS APART-LIKE
PROTEIN HOMOLOG

(Homo sapiens) 		PF07814
(WAPL) 		4 LEU A1036
THR A1125
LEU A1127
LEU A1132
 None
 0.94A 1gtiB-4k6jA:
2.6		 1gtiB-4k6jA:
16.34
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.
4l7m PUTATIVE
UNCHARACTERIZED
PROTEIN

(Thermococcus
onnurineus) 		PF13646
(HEAT_2) 		4 LEU A  41
THR A  49
LEU A  51
LEU A  57
 None
 0.88A 1gtiB-4l7mA:
undetectable		 1gtiB-4l7mA:
21.30
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.
4p8b TRAP-TYPE
TRANSPORTER,
PERIPLASMIC
COMPONENT

(Cupriavidus
necator) 		PF03480
(DctP) 		4 LEU A  39
LEU A 278
GLY A  48
LEU A 244
 X2X  A 403 ( 4.5A)
None
None
None
 0.90A 1gtiB-4p8bA:
undetectable		 1gtiB-4p8bA:
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.
4qvg SIBL

(Streptosporangium
sibiricum) 		PF00891
(Methyltransf_2)
PF16864
(Dimerisation2) 		4 THR A  63
LEU A  67
GLY A  78
LEU A  33
 None
 0.90A 1gtiB-4qvgA:
undetectable		 1gtiB-4qvgA:
22.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4tx8 PROBABLE CHITINASE A

(Chromobacterium
violaceum) 		PF00704
(Glyco_hydro_18) 		4 LEU A 300
LEU A 293
GLY A 295
TYR A 269
 None
 0.89A 1gtiB-4tx8A:
undetectable		 1gtiB-4tx8A:
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.
4unw H3 HAEMAGGLUTININ
HA1 CHAIN

(Influenza A
virus) 		PF00509
(Hemagglutinin) 		4 LEU A 194
THR A 155
LEU A 251
GLY A 249
 None
 0.72A 1gtiB-4unwA:
undetectable		 1gtiB-4unwA:
20.31
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.
4uoo LIPOTEICHOIC ACID
SYNTHASE

(Listeria
monocytogenes) 		PF00884
(Sulfatase) 		4 LEU A 557
THR A 538
LEU A 536
GLY A 554
 None
 0.93A 1gtiB-4uooA:
undetectable		 1gtiB-4uooA:
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.
4wbo RHODOPSIN KINASE

(Bos taurus) 		PF00069
(Pkinase)
PF00615
(RGS) 		4 TRP A 174
THR A 522
GLY A 526
LEU A 528
 None
 0.84A 1gtiB-4wboA:
undetectable		 1gtiB-4wboA:
17.83
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.
4we6 HEMAGGLUTININ HA1
CHAIN

(Influenza A
virus) 		PF00509
(Hemagglutinin) 		4 LEU A 154
THR A 115
LEU A 211
GLY A 209
 None
GOL  A 303 ( 4.6A)
None
None
 0.81A 1gtiB-4we6A:
undetectable		 1gtiB-4we6A:
21.75
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.
4y4m PUTATIVE RIBOSE
1,5-BISPHOSPHATE
ISOMERASE

(Methanocaldococcus
jannaschii) 		PF01946
(Thi4) 		4 THR A 134
LEU A  65
GLY A  43
LEU A  49
 None
None
48F  A 301 (-3.4A)
None
 0.85A 1gtiB-4y4mA:
undetectable		 1gtiB-4y4mA:
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.
4y4n PUTATIVE RIBOSE
1,5-BISPHOSPHATE
ISOMERASE

(Methanotorris
igneus) 		PF01946
(Thi4) 		4 THR A 129
LEU A  58
GLY A  36
LEU A  42
 None
None
48H  A 302 (-3.2A)
None
 0.84A 1gtiB-4y4nA:
undetectable		 1gtiB-4y4nA:
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.
4z45 ODORANT-BINDING
PROTEIN NRIBOBP3

(Nasonovia
ribisnigri) 		PF01395
(PBP_GOBP) 		4 LEU A  67
GLY A  62
LEU A  51
TYR A  58
 None
 0.91A 1gtiB-4z45A:
undetectable		 1gtiB-4z45A:
21.03
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.
5a0t RIBONUCLEASE J

(Streptomyces
coelicolor) 		PF00753
(Lactamase_B)
PF07521
(RMMBL) 		4 LEU A  19
THR A 163
GLY A  17
LEU A  14
 None
 0.85A 1gtiB-5a0tA:
undetectable		 1gtiB-5a0tA:
18.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5a2a APO FORM OF
ANOXYBACILLUS
ALPHA-AMYLASES

(Anoxybacillus
ayderensis) 		PF00128
(Alpha-amylase) 		4 TRP A  29
LEU A 240
LEU A 134
GLY A 209
 None
 0.90A 1gtiB-5a2aA:
undetectable		 1gtiB-5a2aA:
19.26
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.
5bza BETA-N-ACETYLHEXOSAM
INIDASE

(Thermotoga
neapolitana) 		PF00933
(Glyco_hydro_3) 		4 THR A 204
LEU A 241
GLY A 240
LEU A 232
 None
 0.92A 1gtiB-5bzaA:
undetectable		 1gtiB-5bzaA:
15.91
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.
5c2m PREDICTED PROTEIN

(Nematostella
vectensis) 		PF14517
(Tachylectin) 		4 LEU A 225
LEU A 191
GLY A 189
LEU A 167
 None
 0.81A 1gtiB-5c2mA:
undetectable		 1gtiB-5c2mA:
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.
5dyj MYOSIN HEAVY CHAIN
KINASE A

(Dictyostelium
discoideum) 		PF02816
(Alpha_kinase) 		5 LEU A 636
THR A 640
LEU A 600
GLY A 601
LEU A 562
 None
 1.42A 1gtiB-5dyjA:
undetectable		 1gtiB-5dyjA:
20.89
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.
5e6s INTEGRIN ALPHA-L

(Homo sapiens) 		PF00092
(VWA)
PF01839
(FG-GAP)
PF08441
(Integrin_alpha2) 		4 LEU A  70
THR A  66
LEU A  90
GLY A  89
 None
 0.87A 1gtiB-5e6sA:
undetectable		 1gtiB-5e6sA:
15.94
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.
5fmg PROTEASOME SUBUNIT
BETA TYPE

(Plasmodium
falciparum) 		PF00227
(Proteasome) 		4 LEU K 151
THR K 152
GLY K   9
LEU K   7
 None
 0.84A 1gtiB-5fmgK:
undetectable		 1gtiB-5fmgK:
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.
5fzp DISPASE
AUTOLYSIS-INDUCING
PROTEIN

(Streptomyces
mobaraensis) 		no annotation 4 TRP A 201
THR A 171
GLY A 143
LEU A 145
 None
 0.76A 1gtiB-5fzpA:
undetectable		 1gtiB-5fzpA:
19.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5kan HEMAGGLUTININ HA1

(Influenza A
virus) 		PF00509
(Hemagglutinin) 		4 LEU A 194
THR A 155
LEU A 251
GLY A 249
 None
 0.71A 1gtiB-5kanA:
undetectable		 1gtiB-5kanA:
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.
5ln4 PH 6 ANTIGEN,PH 6
ANTIGEN

(Yersinia pestis) 		no annotation 4 TRP A  81
THR A  49
GLY A  55
LEU A  95
 None
 0.94A 1gtiB-5ln4A:
undetectable		 1gtiB-5ln4A:
20.57
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.
5uic TWO-COMPONENT
RESPONSE REGULATOR

(Francisella
tularensis) 		PF00072
(Response_reg) 		4 LEU A 108
LEU A  17
GLY A  15
LEU A  12
 None
 0.94A 1gtiB-5uicA:
undetectable		 1gtiB-5uicA:
24.07
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.
5umn HEMAGGLUTININ

(Influenza A
virus) 		PF00509
(Hemagglutinin) 		4 LEU A 194
THR A 155
LEU A 251
GLY A 249
 None
 0.70A 1gtiB-5umnA:
undetectable		 1gtiB-5umnA:
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.
5uu6 NADPH-FLAVIN
OXIDOREDUCTASE

(Vibrio
parahaemolyticus) 		PF00881
(Nitroreductase) 		4 THR A 149
LEU A 232
GLY A 234
TYR A 231
 None
 0.92A 1gtiB-5uu6A:
undetectable		 1gtiB-5uu6A:
21.07
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.
5w6t HEMAGGLUTININ

(Influenza A
virus) 		PF00509
(Hemagglutinin) 		4 LEU A 194
THR A 155
LEU A 251
GLY A 249
 None
 0.94A 1gtiB-5w6tA:
undetectable		 1gtiB-5w6tA:
20.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5w7a ACYLOXYACYL
HYDROLASE LARGE
SUBUNIT

(Oryctolagus
cuniculus) 		no annotation 4 LEU B 480
THR B 483
LEU B 415
GLY B 417
 None
P6G  B 608 (-3.3A)
None
None
 0.93A 1gtiB-5w7aB:
undetectable		 1gtiB-5w7aB:
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.
5w7c ACYLOXYACYL
HYDROLASE

(Homo sapiens) 		no annotation 4 LEU C 480
THR C 483
LEU C 415
GLY C 417
 None
 0.93A 1gtiB-5w7cC:
undetectable		 1gtiB-5w7cC:
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.
5w7d ACYLOXYACYL
HYDROLASE

(Mus musculus) 		no annotation 4 LEU A 479
THR A 482
LEU A 414
GLY A 416
 None
 0.94A 1gtiB-5w7dA:
undetectable		 1gtiB-5w7dA:
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.
5xqo PCRGLX PROTEIN

(Penicillium
chrysogenum) 		no annotation 4 TRP A  89
LEU A 504
GLY A  47
LEU A 661
 None
 0.82A 1gtiB-5xqoA:
1.4		 1gtiB-5xqoA:
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.
5yd0 SCHLAFEN 8

(Rattus
norvegicus) 		no annotation 4 LEU A 201
LEU A 254
GLY A 198
LEU A 195
 None
 0.87A 1gtiB-5yd0A:
undetectable		 1gtiB-5yd0A:
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.
6bkp HEMAGGLUTININ

(Influenza A
virus) 		no annotation 4 LEU A 194
THR A 155
LEU A 251
GLY A 249
 None
 0.81A 1gtiB-6bkpA:
undetectable		 1gtiB-6bkpA:
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.
6brs PUTATIVE ZINC
PROTEASE

(Pectobacterium
atrosepticum) 		no annotation 4 LEU A 582
LEU A 568
GLY A 628
LEU A 623
 HG  A1006 (-4.6A)
None
None
None
 0.74A 1gtiB-6brsA:
undetectable		 1gtiB-6brsA:
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.
6chd LYSINE--TRNA LIGASE

(Homo sapiens) 		no annotation 4 LEU A 258
GLY A 262
LEU A 264
TYR A 316
 None
 0.92A 1gtiB-6chdA:
undetectable		 1gtiB-6chdA:
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.
6eon BETA-GALACTOSIDASE

(Bacteroides
thetaiotaomicron) 		no annotation 4 LEU A 461
THR A 409
GLY A 458
LEU A 455
 None
 0.87A 1gtiB-6eonA:
undetectable		 1gtiB-6eonA:
14.45
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.
6et0 PQSB

(Pseudomonas
aeruginosa) 		no annotation 4 LEU B 247
LEU B 151
GLY B   7
LEU B 148
 None
 0.86A 1gtiB-6et0B:
undetectable		 1gtiB-6et0B:
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.
6fml INO80

(Chaetomium
thermophilum) 		no annotation 4 TRP G 982
LEU G1133
GLY G 993
LEU G 983
 None
 0.82A 1gtiB-6fmlG:
undetectable		 1gtiB-6fmlG:
undetectable