SIMILAR PATTERNS OF AMINO ACIDS FOR 3SMT_A_ACTA1001

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.
1d9z EXCINUCLEASE UVRABC
COMPONENT UVRB

([Bacillus]
caldotenax) 		PF00271
(Helicase_C)
PF04851
(ResIII)
PF12344
(UvrB) 		4 LEU A 148
GLY A 147
PHE A 249
ARG A 123
 None
 1.02A 3smtA-1d9zA:
0.0		 3smtA-1d9zA:
23.11
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.
1do6 SUPEROXIDE REDUCTASE

(Pyrococcus
furiosus) 		PF01880
(Desulfoferrodox) 		4 LEU A 123
GLY A 103
PHE A  56
ARG A  24
 None
 0.92A 3smtA-1do6A:
undetectable		 3smtA-1do6A:
14.20
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.
1f76 DIHYDROOROTATE
DEHYDROGENASE
(QUINONE)

(Escherichia
coli) 		PF01180
(DHO_dh) 		4 LEU A  74
GLY A  75
PHE A  79
PHE A 321
 None
 1.14A 3smtA-1f76A:
0.0		 3smtA-1f76A:
21.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1fch PEROXISOMAL
TARGETING SIGNAL 1
RECEPTOR

(Homo sapiens) 		PF13374
(TPR_10)
PF13432
(TPR_16) 		4 LEU A 577
GLY A 578
PHE A 598
ARG A 536
 None
 0.99A 3smtA-1fchA:
0.0		 3smtA-1fchA:
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.
1g5i MITOCHONDRIAL DNA
POLYMERASE ACCESSORY
SUBUNIT

(Mus musculus) 		PF03129
(HGTP_anticodon) 		4 LEU A 321
GLY A 319
PHE A  73
ARG A  72
 None
 0.86A 3smtA-1g5iA:
0.0		 3smtA-1g5iA:
23.02
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.
1h74 HOMOSERINE KINASE

(Methanocaldococcus
jannaschii) 		PF00288
(GHMP_kinases_N)
PF08544
(GHMP_kinases_C) 		4 LEU A  27
GLY A  26
PHE A 150
PHE A 221
 None
 1.00A 3smtA-1h74A:
0.0		 3smtA-1h74A:
22.81
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.
1i2m REGULATOR OF
CHROMOSOME
CONDENSATION 1

(Homo sapiens) 		PF00415
(RCC1) 		4 LEU B 272
GLY B 273
PHE B 289
PHE B 253
 None
 0.86A 3smtA-1i2mB:
0.0		 3smtA-1i2mB:
21.44
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.
1i6q LACTOFERRIN

(Camelus
dromedarius) 		PF00405
(Transferrin) 		4 LEU A 533
PHE A 530
PHE A 569
ARG A 440
 None
 1.05A 3smtA-1i6qA:
0.0		 3smtA-1i6qA:
23.67
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.
1jax CONSERVED
HYPOTHETICAL PROTEIN

(Archaeoglobus
fulgidus) 		PF03807
(F420_oxidored) 		4 LEU A 174
GLY A 173
PHE A 147
PHE A 140
 None
 0.93A 3smtA-1jaxA:
0.0		 3smtA-1jaxA:
18.20
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.
1k4j ACYL-HOMOSERINELACTO
NE SYNTHASE ESAI

(Pantoea
stewartii) 		PF00765
(Autoind_synth) 		4 LEU A  63
GLY A  41
PHE A 102
ARG A 107
 None
 1.17A 3smtA-1k4jA:
undetectable		 3smtA-1k4jA:
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.
1kgd PERIPHERAL PLASMA
MEMBRANE CASK

(Homo sapiens) 		PF00625
(Guanylate_kin) 		4 LEU A 740
GLY A 741
PHE A 851
PHE A 885
 None
 1.08A 3smtA-1kgdA:
undetectable		 3smtA-1kgdA:
16.50
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.
1kjw POSTSYNAPTIC DENSITY
PROTEIN 95

(Rattus
norvegicus) 		PF00018
(SH3_1)
PF00625
(Guanylate_kin) 		4 LEU A 540
GLY A 541
PHE A 649
PHE A 688
 None
 1.11A 3smtA-1kjwA:
undetectable		 3smtA-1kjwA:
20.16
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.
1lfw PEPV

(Lactobacillus
delbrueckii) 		PF01546
(Peptidase_M20) 		4 LEU A 316
GLY A 317
PHE A 368
PHE A 302
 None
 1.19A 3smtA-1lfwA:
undetectable		 3smtA-1lfwA:
24.59
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.
1lur ALDOSE 1-EPIMERASE

(Caenorhabditis
elegans) 		PF01263
(Aldose_epim) 		4 GLY A1206
PHE A1207
PHE A1186
ARG A1200
 None
 1.21A 3smtA-1lurA:
undetectable		 3smtA-1lurA:
23.53
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.
1now BETA-HEXOSAMINIDASE
BETA CHAIN

(Homo sapiens) 		PF00728
(Glyco_hydro_20)
PF14845
(Glycohydro_20b2) 		4 LEU A 469
PHE A 481
PHE A 200
ARG A 199
 None
 1.15A 3smtA-1nowA:
undetectable		 3smtA-1nowA:
22.44
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.
1tuu ACETATE KINASE

(Methanosarcina
thermophila) 		PF00871
(Acetate_kinase) 		4 LEU A 209
GLY A 210
PHE A 284
PHE A 305
 None
ADP  A 401 (-3.3A)
ADP  A 401 (-4.3A)
None
 0.81A 3smtA-1tuuA:
undetectable		 3smtA-1tuuA:
23.55
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.
1u05 ORF, CONSERVED
HYPOTHETICAL PROTEIN

(Shigella
flexneri) 		PF02578
(Cu-oxidase_4) 		4 LEU A 130
GLY A 129
PHE A 172
ARG A 201
 None
 0.94A 3smtA-1u05A:
undetectable		 3smtA-1u05A:
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.
1v5w MEIOTIC
RECOMBINATION
PROTEIN DMC1/LIM15
HOMOLOG

(Homo sapiens) 		PF08423
(Rad51) 		4 LEU A 135
GLY A 131
PHE A 328
PHE A 108
 None
 0.91A 3smtA-1v5wA:
undetectable		 3smtA-1v5wA:
20.82
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.
1v9t CYCLOPHILIN B

(Escherichia
coli) 		PF00160
(Pro_isomerase) 		4 LEU A  20
GLY A 126
PHE A 125
PHE A  32
 None
 1.16A 3smtA-1v9tA:
undetectable		 3smtA-1v9tA:
15.64
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.
1vpa 2-C-METHYL-D-ERYTHRI
TOL 4-PHOSPHATE
CYTIDYLYLTRANSFERASE

(Thermotoga
maritima) 		PF01128
(IspD) 		4 LEU A  70
GLY A  71
PHE A  89
PHE A  93
 None
 1.14A 3smtA-1vpaA:
undetectable		 3smtA-1vpaA:
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.
1w74 PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
A

(Mycobacterium
tuberculosis) 		PF00160
(Pro_isomerase) 		4 LEU A  30
GLY A 145
PHE A 144
PHE A  42
 None
 1.16A 3smtA-1w74A:
undetectable		 3smtA-1w74A:
17.26
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.
1wy2 XAA-PRO DIPEPTIDASE

(Pyrococcus
horikoshii) 		PF00557
(Peptidase_M24)
PF01321
(Creatinase_N) 		4 LEU A 285
GLY A 286
PHE A 281
ARG A 269
 None
 1.21A 3smtA-1wy2A:
undetectable		 3smtA-1wy2A:
20.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1x9d ENDOPLASMIC
RETICULUM
MANNOSYL-OLIGOSACCHA
RIDE
1,2-ALPHA-MANNOSIDAS
E

(Homo sapiens) 		PF01532
(Glyco_hydro_47) 		4 LEU A 681
PHE A 686
PHE A 605
ARG A 609
 None
 0.83A 3smtA-1x9dA:
undetectable		 3smtA-1x9dA:
22.95
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.
1zkc PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
LIKE 2

(Homo sapiens) 		PF00160
(Pro_isomerase) 		4 LEU A 295
GLY A 398
PHE A 397
PHE A 307
 None
 1.17A 3smtA-1zkcA:
undetectable		 3smtA-1zkcA:
17.10
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.
2a2n PEPTIDYLPROLYL
ISOMERASE DOMAIN AND
WD REPEAT CONTAINING
1

(Homo sapiens) 		PF00160
(Pro_isomerase) 		4 LEU A 507
GLY A 610
PHE A 609
PHE A 519
 None
 1.09A 3smtA-2a2nA:
undetectable		 3smtA-2a2nA:
17.54
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.
2b5m DAMAGE-SPECIFIC DNA
BINDING PROTEIN 1

(Homo sapiens) 		PF03178
(CPSF_A)
PF10433
(MMS1_N) 		4 LEU A 582
GLY A 583
PHE A 612
ARG A 626
 None
 0.99A 3smtA-2b5mA:
undetectable		 3smtA-2b5mA:
18.66
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.
2exr CYTOKININ
DEHYDROGENASE 7

(Arabidopsis
thaliana) 		PF01565
(FAD_binding_4)
PF09265
(Cytokin-bind) 		4 LEU A 222
GLY A 223
PHE A 225
PHE A 500
 None
FAD  A 525 (-3.6A)
None
None
 1.18A 3smtA-2exrA:
undetectable		 3smtA-2exrA:
23.37
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.
2gk1 BETA-HEXOSAMINIDASE
SUBUNIT BETA CHAIN B
BETA-HEXOSAMINIDASE
SUBUNIT BETA CHAIN A

(Homo sapiens;
Homo sapiens) 		no annotation
no annotation 		4 LEU N 469
PHE N 481
PHE M 200
ARG M 199
 None
 1.11A 3smtA-2gk1N:
undetectable		 3smtA-2gk1N:
17.92
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.
2hvb SUPEROXIDE REDUCTASE

(Pyrococcus
horikoshii) 		PF01880
(Desulfoferrodox) 		4 LEU A 123
GLY A 103
PHE A  65
ARG A  33
 None
 0.88A 3smtA-2hvbA:
undetectable		 3smtA-2hvbA:
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.
2poe CYCLOPHILIN-LIKE
PROTEIN, PUTATIVE

(Cryptosporidium
parvum) 		PF00160
(Pro_isomerase) 		4 LEU A  32
GLY A 139
PHE A 138
PHE A  44
 None
 1.20A 3smtA-2poeA:
undetectable		 3smtA-2poeA:
16.50
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.
2pzi PROBABLE
SERINE/THREONINE-PRO
TEIN KINASE PKNG

(Mycobacterium
tuberculosis) 		PF00069
(Pkinase)
PF16918
(PknG_TPR)
PF16919
(PknG_rubred) 		4 LEU A 704
GLY A 705
PHE A 706
ARG A 682
 None
 1.17A 3smtA-2pziA:
undetectable		 3smtA-2pziA:
21.04
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.
3axs PROBABLE
N(2),N(2)-DIMETHYLGU
ANOSINE TRNA
METHYLTRANSFERASE
TRM1

(Aquifex
aeolicus) 		PF02005
(TRM) 		4 LEU A  41
GLY A  42
PHE A 292
ARG A 300
 None
 0.67A 3smtA-3axsA:
undetectable		 3smtA-3axsA:
22.20
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.
3dyt SORTING NEXIN-9

(Homo sapiens) 		PF00787
(PX)
PF10456
(BAR_3_WASP_bdg) 		4 LEU A 500
GLY A 501
PHE A 503
PHE A 555
 None
 1.17A 3smtA-3dytA:
undetectable		 3smtA-3dytA:
20.72
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.
3f2a PROTO-ONCOGENE
SERINE/THREONINE-PRO
TEIN KINASE PIM-1

(Homo sapiens) 		PF00069
(Pkinase) 		4 LEU A 139
PHE A 147
PHE A 132
ARG A 136
 None
 1.14A 3smtA-3f2aA:
undetectable		 3smtA-3f2aA:
22.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3goz LEUCINE-RICH
REPEAT-CONTAINING
PROTEIN

(Legionella
pneumophila) 		no annotation 4 LEU A 145
GLY A 117
PHE A 121
PHE A 133
 None
 1.14A 3smtA-3gozA:
undetectable		 3smtA-3gozA:
20.94
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.
3hdn SERINE/THREONINE-PRO
TEIN KINASE SGK1

(Homo sapiens) 		PF00069
(Pkinase) 		4 LEU A 151
GLY A 242
PHE A 241
PHE A 174
 None
 1.16A 3smtA-3hdnA:
undetectable		 3smtA-3hdnA:
22.66
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.
3idv PROTEIN
DISULFIDE-ISOMERASE
A4

(Homo sapiens) 		PF00085
(Thioredoxin) 		4 GLY A 261
PHE A 258
PHE A 247
ARG A 246
 None
 1.18A 3smtA-3idvA:
undetectable		 3smtA-3idvA:
19.56
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.
3j6d PROTEIN PRGH

(Salmonella
enterica) 		PF09480
(PrgH) 		4 LEU A 307
GLY A 306
PHE A 342
PHE A 357
 None
 1.09A 3smtA-3j6dA:
undetectable		 3smtA-3j6dA:
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.
3jb9 PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
PPI1

(Schizosaccharomyces
pombe) 		PF01423
(LSM) 		4 LEU d  17
GLY d 120
PHE d 119
PHE d  29
 None
 1.11A 3smtA-3jb9d:
undetectable		 3smtA-3jb9d:
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.
3kng SNOAB

(Streptomyces
nogalater) 		PF03992
(ABM) 		4 LEU A  99
GLY A  98
PHE A  16
PHE A  73
 None
 1.06A 3smtA-3kngA:
undetectable		 3smtA-3kngA:
18.21
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.
3krz NADH:FLAVIN
OXIDOREDUCTASE/NADH
OXIDASE

(Thermoanaerobacter
pseudethanolicus) 		PF00724
(Oxidored_FMN) 		4 LEU A 169
GLY A 117
PHE A 173
PHE A 195
 None
 1.15A 3smtA-3krzA:
undetectable		 3smtA-3krzA:
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.
3n9o PUTATIVE
UNCHARACTERIZED
PROTEIN

(Caenorhabditis
elegans) 		PF02373
(JmjC) 		4 LEU A 346
GLY A 347
PHE A 343
PHE A 356
 None
 1.08A 3smtA-3n9oA:
undetectable		 3smtA-3n9oA:
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.
3nr8 PHOSPHATIDYLINOSITOL
-3,4,5-TRISPHOSPHATE
5-PHOSPHATASE 2

(Homo sapiens) 		no annotation 4 LEU B 489
GLY B 488
PHE B 446
PHE B 469
 None
 1.19A 3smtA-3nr8B:
undetectable		 3smtA-3nr8B:
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.
3prc PHOTOSYNTHETIC
REACTION CENTER

(Blastochloris
viridis) 		PF00124
(Photo_RC) 		4 LEU L  94
GLY L  95
PHE L  97
PHE L 128
 None
None
BCB  L 302 ( 3.8A)
None
 0.88A 3smtA-3prcL:
undetectable		 3smtA-3prcL:
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.
3qqm MLR3007 PROTEIN

(Mesorhizobium
loti) 		PF01063
(Aminotran_4) 		4 LEU A  46
GLY A  47
PHE A  48
PHE A  15
 CL  A 250 (-4.3A)
None
None
None
 1.08A 3smtA-3qqmA:
undetectable		 3smtA-3qqmA:
20.72
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.
3r9p ACKA

(Mycobacterium
avium) 		PF00871
(Acetate_kinase) 		4 LEU A 198
GLY A 199
PHE A 272
PHE A 293
 None
PGE  A 390 ( 4.4A)
None
None
 1.10A 3smtA-3r9pA:
undetectable		 3smtA-3r9pA:
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.
3rnl SULFOTRANSFERASE

(Alicyclobacillus
acidocaldarius) 		PF13469
(Sulfotransfer_3) 		4 LEU A 163
GLY A 162
PHE A 280
PHE A 279
 None
 0.76A 3smtA-3rnlA:
undetectable		 3smtA-3rnlA:
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.
3s6m PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE

(Burkholderia
pseudomallei) 		PF00160
(Pro_isomerase) 		4 LEU A  15
GLY A 124
PHE A 123
PHE A  27
 None
PEG  A 165 (-3.7A)
None
None
 1.10A 3smtA-3s6mA:
undetectable		 3smtA-3s6mA:
15.53
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3smt HISTONE-LYSINE
N-METHYLTRANSFERASE
SETD3

(Homo sapiens) 		PF00856
(SET)
PF09273
(Rubis-subs-bind) 		5 LEU A 340
GLY A 341
PHE A 387
PHE A 428
ARG A 432
 ACT  A1001 (-3.9A)
ACT  A1001 (-3.9A)
ACT  A1001 (-4.1A)
ACT  A1001 (-4.8A)
ACT  A1001 (-3.1A)
 0.00A 3smtA-3smtA:
57.8		 3smtA-3smtA:
100.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3syj ADHESION AND
PENETRATION PROTEIN
AUTOTRANSPORTER

(Haemophilus
influenzae) 		PF02395
(Peptidase_S6)
PF03212
(Pertactin) 		4 LEU A 476
GLY A 503
PHE A 498
PHE A 496
 None
 1.01A 3smtA-3syjA:
undetectable		 3smtA-3syjA:
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.
3uat DISKS LARGE HOMOLOG
1

(Rattus
norvegicus) 		PF00625
(Guanylate_kin)
PF07653
(SH3_2) 		4 LEU A 727
GLY A 728
PHE A 836
PHE A 875
 None
 1.17A 3smtA-3uatA:
undetectable		 3smtA-3uatA:
21.33
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.
3umv DEOXYRIBODIPYRIMIDIN
E PHOTO-LYASE

(Oryza sativa) 		PF00875
(DNA_photolyase) 		4 LEU A 284
GLY A 283
PHE A 260
PHE A 316
 None
EDO  A 701 ( 3.2A)
None
None
 1.15A 3smtA-3umvA:
undetectable		 3smtA-3umvA:
22.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3v85 CYTH-LIKE
PHOSPHATASE

(Arabidopsis
thaliana) 		PF01928
(CYTH) 		4 LEU A 136
GLY A 137
PHE A  36
PHE A 201
 None
 1.17A 3smtA-3v85A:
undetectable		 3smtA-3v85A:
19.09
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.
3vwa CYTOPLASMIC EXPORT
PROTEIN 1

(Saccharomyces
cerevisiae) 		no annotation 4 LEU A 376
GLY A 374
PHE A 342
PHE A 346
 None
 1.12A 3smtA-3vwaA:
undetectable		 3smtA-3vwaA:
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.
3w0f ENDONUCLEASE 8-LIKE
3

(Mus musculus) 		PF06831
(H2TH) 		4 LEU A  80
GLY A  81
PHE A  85
ARG A 147
 None
 1.07A 3smtA-3w0fA:
undetectable		 3smtA-3w0fA:
20.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3w9h ACRIFLAVINE
RESISTANCE PROTEIN B

(Escherichia
coli) 		PF00873
(ACR_tran) 		4 LEU A 960
GLY A 959
PHE A1026
ARG A1030
 None
 0.87A 3smtA-3w9hA:
undetectable		 3smtA-3w9hA:
19.80
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.
3wp0 DISKS LARGE HOMOLOG
4

(Rattus
norvegicus) 		PF00625
(Guanylate_kin) 		4 LEU A 540
GLY A 541
PHE A 649
PHE A 688
 None
 1.19A 3smtA-3wp0A:
undetectable		 3smtA-3wp0A:
17.87
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.
4b8a POLY(A) RIBONUCLEASE
POP2

(Saccharomyces
cerevisiae) 		PF04857
(CAF1) 		4 LEU B  81
GLY B  82
PHE B 102
PHE B 141
 None
 1.00A 3smtA-4b8aB:
undetectable		 3smtA-4b8aB:
19.88
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.
4ccs CBIX

(Paracoccus
pantotrophus) 		PF01903
(CbiX) 		4 LEU A  44
GLY A  11
PHE A  69
ARG A  77
 EDO  A1229 (-3.9A)
EDO  A1229 (-3.2A)
EDO  A1229 ( 4.8A)
EDO  A1229 ( 4.0A)
 0.60A 3smtA-4ccsA:
undetectable		 3smtA-4ccsA:
16.73
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.
4cni INTERLEUKIN-6

(Homo sapiens) 		PF00489
(IL6) 		4 LEU C  91
GLY C  90
PHE C  94
PHE C 170
 None
 1.20A 3smtA-4cniC:
undetectable		 3smtA-4cniC:
15.62
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.
4gj4 SOLUBLE GUANYLYL
CYCLASE ALPHA-1
SUBUNIT

(Manduca sexta) 		PF07701
(HNOBA) 		4 LEU A 303
GLY A 304
PHE A 307
PHE A 326
 None
 1.15A 3smtA-4gj4A:
undetectable		 3smtA-4gj4A:
15.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4gmj CCR4-NOT
TRANSCRIPTION
COMPLEX SUBUNIT 7

(Homo sapiens) 		PF04857
(CAF1) 		4 LEU B  77
GLY B  78
PHE B  97
PHE B 136
 None
 1.09A 3smtA-4gmjB:
undetectable		 3smtA-4gmjB:
20.55
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.
4gt2 PUTATIVE
UNCHARACTERIZED
PROTEIN SCO3963

(Streptomyces
coelicolor) 		no annotation 4 LEU B 442
GLY B 439
PHE B 156
PHE B 160
 None
 1.02A 3smtA-4gt2B:
undetectable		 3smtA-4gt2B:
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.
4haq GH7 FAMILY PROTEIN

(Limnoria
quadripunctata) 		PF00840
(Glyco_hydro_7) 		4 LEU A 288
GLY A 289
PHE A 340
PHE A 362
 None
 1.03A 3smtA-4haqA:
undetectable		 3smtA-4haqA:
23.25
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.
4hyy MEIOTIC
RECOMBINATION
PROTEIN DMC1/LIM15
HOMOLOG

(Homo sapiens) 		PF08423
(Rad51) 		4 LEU A 135
GLY A 131
PHE A 328
PHE A 108
 None
 0.82A 3smtA-4hyyA:
undetectable		 3smtA-4hyyA:
18.27
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.
4iw7 8-AMINO-7-OXONONANOA
TE SYNTHASE

(Francisella
tularensis) 		PF00155
(Aminotran_1_2) 		4 LEU A 218
GLY A 226
PHE A  92
PHE A  77
 None
 0.99A 3smtA-4iw7A:
undetectable		 3smtA-4iw7A:
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.
4ks9 MALONYL-COA
DECARBOXYLASE

(Cupriavidus
metallidurans) 		PF05292
(MCD)
PF17408
(MCD_N) 		4 LEU A 297
GLY A 296
PHE A 187
PHE A 191
 None
 1.21A 3smtA-4ks9A:
undetectable		 3smtA-4ks9A:
22.80
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.
4ksa MALONYL-COA
DECARBOXYLASE

(Rhodopseudomonas
palustris) 		PF05292
(MCD)
PF17408
(MCD_N) 		4 LEU A 281
GLY A 280
PHE A 170
PHE A 174
 None
 1.14A 3smtA-4ksaA:
undetectable		 3smtA-4ksaA:
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.
4l37 ARYLPHORIN

(Bombyx mori) 		PF00372
(Hemocyanin_M)
PF03722
(Hemocyanin_N)
PF03723
(Hemocyanin_C) 		4 LEU B 636
GLY B 637
PHE B 629
ARG B 244
 None
 0.84A 3smtA-4l37B:
undetectable		 3smtA-4l37B:
21.55
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.
4mla CYTOKININ OXIDASE 2

(Zea mays) 		PF01565
(FAD_binding_4)
PF09265
(Cytokin-bind) 		4 LEU A 218
GLY A 219
PHE A 221
PHE A 490
 None
FAD  A 601 (-3.5A)
None
None
 1.17A 3smtA-4mlaA:
undetectable		 3smtA-4mlaA:
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.
4muo UNCHARACTERIZED
PROTEIN YBIB

(Escherichia
coli) 		PF02885
(Glycos_trans_3N) 		4 LEU A 108
GLY A 109
PHE A 110
ARG A 315
 None
 1.13A 3smtA-4muoA:
undetectable		 3smtA-4muoA:
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.
4ow8 SERINE/THREONINE-PRO
TEIN KINASE PKNA

(Mycobacterium
tuberculosis) 		PF00069
(Pkinase) 		4 LEU A  44
GLY A  25
PHE A  48
PHE A  54
 None
 1.11A 3smtA-4ow8A:
undetectable		 3smtA-4ow8A:
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.
4r3f SPLICEOSOMAL PROTEIN
CWC27

(Chaetomium
thermophilum) 		PF00160
(Pro_isomerase) 		4 LEU A  28
GLY A 157
PHE A 156
PHE A  40
 None
 1.17A 3smtA-4r3fA:
undetectable		 3smtA-4r3fA:
17.24
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.
4wp0 KYNURENINE--OXOGLUTA
RATE TRANSAMINASE 1

(Homo sapiens) 		PF00155
(Aminotran_1_2) 		4 LEU A 329
GLY A 328
PHE A 347
PHE A 366
 None
 1.18A 3smtA-4wp0A:
undetectable		 3smtA-4wp0A:
21.83
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.
4zng PROLIDASE

(Lactococcus
lactis) 		no annotation 4 LEU C 294
GLY C 295
PHE C 290
ARG C 278
 None
 1.17A 3smtA-4zngC:
undetectable		 3smtA-4zngC:
20.96
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.
5e6s INTEGRIN BETA-2

(Homo sapiens) 		PF00362
(Integrin_beta)
PF17205
(PSI_integrin) 		4 LEU B 215
GLY B 213
PHE B 149
PHE B 239
 None
 1.16A 3smtA-5e6sB:
undetectable		 3smtA-5e6sB:
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.
5ex1 PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
CYCLOPHILIN TYPE

(Hirschia
baltica) 		PF00160
(Pro_isomerase) 		4 LEU A  51
GLY A 184
PHE A 183
PHE A  63
 None
 1.20A 3smtA-5ex1A:
undetectable		 3smtA-5ex1A:
19.16
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.
5gmo PROTEIN INDUCED BY
OSMOTIC STRESS

(Scheffersomyces
stipitis) 		PF01370
(Epimerase) 		4 LEU A 271
GLY A 268
PHE A 266
PHE A 196
 None
 0.87A 3smtA-5gmoA:
undetectable		 3smtA-5gmoA:
22.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5hct ENDOTHIAPEPSIN

(Cryphonectria
parasitica) 		PF00026
(Asp) 		4 LEU A  99
GLY A   3
PHE A 171
PHE A 144
 None
 1.15A 3smtA-5hctA:
undetectable		 3smtA-5hctA:
22.66
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.
5hx6 RECEPTOR-INTERACTING
SERINE/THREONINE-PRO
TEIN KINASE 1

(Homo sapiens) 		PF07714
(Pkinase_Tyr) 		4 LEU A 293
GLY A 116
PHE A 285
PHE A 288
 None
 1.21A 3smtA-5hx6A:
undetectable		 3smtA-5hx6A:
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.
5idj CELL CYCLE HISTIDINE
KINASE CCKA

(Caulobacter
vibrioides) 		PF00512
(HisKA)
PF02518
(HATPase_c) 		4 LEU A 463
GLY A 464
PHE A 539
PHE A 474
 None
 1.11A 3smtA-5idjA:
undetectable		 3smtA-5idjA:
17.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5idm CELL CYCLE HISTIDINE
KINASE CCKA

(Caulobacter
vibrioides) 		PF02518
(HATPase_c) 		4 LEU A 463
GLY A 464
PHE A 539
PHE A 474
 None
 1.11A 3smtA-5idmA:
undetectable		 3smtA-5idmA:
16.87
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.
5ihx TYROSINE--TRNA
LIGASE,
MITOCHONDRIAL

(Aspergillus
nidulans) 		PF00579
(tRNA-synt_1b) 		4 LEU A 156
GLY A 151
PHE A  95
PHE A 119
 None
 1.19A 3smtA-5ihxA:
undetectable		 3smtA-5ihxA:
20.58
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.
5k0u CAPSID PROTEIN VP3
CAPSID PROTEIN VP2

(Rhinovirus C;
Rhinovirus C) 		PF00073
(Rhv)
PF00073
(Rhv) 		4 LEU B 156
GLY B 126
PHE B 196
ARG C 197
 None
 1.04A 3smtA-5k0uB:
undetectable		 3smtA-5k0uB:
19.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5k1z AMINODEOXYFUTALOSINE
NUCLEOSIDASE

(Helicobacter
pylori) 		PF01048
(PNP_UDP_1) 		4 LEU A 111
GLY A 112
PHE A 167
PHE A 162
 None
 1.15A 3smtA-5k1zA:
undetectable		 3smtA-5k1zA:
19.30
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.
5k2y PROBABLE PERIPLASMIC
SUGAR-BINDING
LIPOPROTEIN USPC

(Mycobacterium
tuberculosis) 		PF01547
(SBP_bac_1) 		4 LEU A 409
GLY A 405
PHE A 238
PHE A 232
 None
 1.16A 3smtA-5k2yA:
undetectable		 3smtA-5k2yA:
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.
5lg9 UNCHARACTERIZED
PROTEIN

(Plasmodium
falciparum) 		no annotation 4 LEU A  59
GLY A  17
PHE A  11
PHE A  94
 None
 1.20A 3smtA-5lg9A:
undetectable		 3smtA-5lg9A:
16.80
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.
5map DTPA

(Streptomyces
lividans) 		PF04261
(Dyp_perox) 		4 LEU A 442
GLY A 439
PHE A 156
PHE A 160
 None
 1.09A 3smtA-5mapA:
undetectable		 3smtA-5mapA:
22.18
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.
5nux CHROMATE REDUCTASE

(Thermus
scotoductus) 		no annotation 4 LEU A 178
GLY A 126
PHE A 182
PHE A 204
 None
 1.19A 3smtA-5nuxA:
undetectable		 3smtA-5nuxA:
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.
5o5c PUTATIVE
DECARBOXYLASE
INVOLVED IN
DESFERRIOXAMINE
BIOSYNTHESIS

(Erwinia
amylovora) 		no annotation 4 LEU A 303
GLY A 300
PHE A 402
ARG A 312
 None
 1.17A 3smtA-5o5cA:
undetectable		 3smtA-5o5cA:
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.
5ol6 NUCLEIC ACID
BINDING, OB-FOLD,
TRNA/HELICASE-TYPE,D
NA-DIRECTED DNA
POLYMERASE

(Nostoc
punctiforme) 		no annotation 4 LEU A 102
GLY A 105
PHE A  32
ARG A 138
 None
 1.19A 3smtA-5ol6A:
undetectable		 3smtA-5ol6A:
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.
5oqm GENERAL
TRANSCRIPTION AND
DNA REPAIR FACTOR
IIH HELICASE SUBUNIT
XPB

(Saccharomyces
cerevisiae) 		no annotation 4 LEU 7 527
GLY 7 525
PHE 7 529
ARG 7 499
 None
 1.18A 3smtA-5oqm7:
undetectable		 3smtA-5oqm7:
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.
5p60 ENDOTHIAPEPSIN

(Cryphonectria
parasitica) 		PF00026
(Asp) 		4 LEU A  99
GLY A   3
PHE A 171
PHE A 144
 None
 1.15A 3smtA-5p60A:
undetectable		 3smtA-5p60A:
21.66
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.
5t38 EVDMO1

(Micromonospora
carbonacea) 		PF13847
(Methyltransf_31) 		4 LEU A 120
GLY A 121
PHE A 123
ARG A 108
 None
 0.95A 3smtA-5t38A:
undetectable		 3smtA-5t38A:
21.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5tcp PROTEIN PRGH

(Salmonella
enterica) 		PF09480
(PrgH) 		4 LEU 1 307
GLY 1 306
PHE 1 342
PHE 1 357
 None
 1.14A 3smtA-5tcp1:
undetectable		 3smtA-5tcp1:
18.18
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.
5u4v RHO
GTPASE-ACTIVATING
PROTEIN 5

(Homo sapiens) 		no annotation 4 LEU A 601
GLY A 602
PHE A 670
PHE A 674
 None
 1.12A 3smtA-5u4vA:
undetectable		 3smtA-5u4vA:
19.87
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.
5y0s THERMOTOGA MARITIMA
TMCAL

(Thermotoga
maritima) 		no annotation 4 LEU A 279
GLY A 278
PHE A 305
ARG A 309
 None
 1.10A 3smtA-5y0sA:
undetectable		 3smtA-5y0sA:
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.
5z06 BDI_3064 PROTEIN

(Parabacteroides
distasonis) 		no annotation 4 LEU A 265
GLY A 266
PHE A 243
ARG A 241
 None
 0.96A 3smtA-5z06A:
undetectable		 3smtA-5z06A:
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.
6b8s DIHYDROOROTATE
DEHYDROGENASE
(QUINONE)

(Helicobacter
pylori) 		no annotation 4 LEU A 322
GLY A 319
PHE A 315
PHE A  84
 None
PGE  A 402 ( 4.2A)
PGE  A 402 (-4.0A)
None
 1.21A 3smtA-6b8sA:
undetectable		 3smtA-6b8sA:
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.
6g1i -

(-) 		no annotation 4 LEU A 291
GLY A 290
PHE A 270
PHE A 195
 None
 0.84A 3smtA-6g1iA:
1.0		 3smtA-6g1iA:
undetectable