SIMILAR PATTERNS OF AMINO ACIDS FOR 3FW1_A_STIA233

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.
1lns X-PROLYL DIPEPTIDYL
AMINOPEPTIDASE

(Lactococcus
lactis) 		PF02129
(Peptidase_S15)
PF08530
(PepX_C)
PF09168
(PepX_N) 		5 GLY A 297
GLY A 291
THR A 292
TYR A 406
ILE A 188
 None
 1.22A 3fw1A-1lnsA:
2.1		 3fw1A-1lnsA:
15.18
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.
1poi GLUTACONATE COENZYME
A-TRANSFERASE

(Acidaminococcus
fermentans) 		PF01144
(CoA_trans) 		5 PHE A  87
GLY A  52
GLY A  51
TYR A  70
ASN A  72
 None
 1.34A 3fw1A-1poiA:
undetectable		 3fw1A-1poiA:
21.45
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1qbg NAD(P)H
DEHYDROGENASE
[QUINONE] 1

(Homo sapiens) 		PF02525
(Flavodoxin_2) 		5 PHE A 106
GLY A 149
GLY A 150
MET A 154
TYR A 155
 FAD  A 501 (-3.9A)
FAD  A 501 (-3.9A)
FAD  A 501 (-4.0A)
None
FAD  A 501 (-4.9A)
 0.62A 3fw1A-1qbgA:
32.8		 3fw1A-1qbgA:
40.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1qbg NAD(P)H
DEHYDROGENASE
[QUINONE] 1

(Homo sapiens) 		PF02525
(Flavodoxin_2) 		5 TRP A 105
GLY A 149
GLY A 150
MET A 154
TYR A 155
 FAD  A 501 (-4.5A)
FAD  A 501 (-3.9A)
FAD  A 501 (-4.0A)
None
FAD  A 501 (-4.9A)
 0.57A 3fw1A-1qbgA:
32.8		 3fw1A-1qbgA:
40.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1qrd QUINONE-REDUCTASE

(Rattus rattus) 		PF02525
(Flavodoxin_2) 		6 TRP A 105
PHE A 106
GLY A 149
GLY A 150
MET A 154
TYR A 155
 DQN  A 276 ( 3.6A)
DQN  A 276 ( 4.2A)
CBD  A 275 ( 3.7A)
FAD  A 274 (-3.7A)
CBD  A 275 ( 4.4A)
None
 0.48A 3fw1A-1qrdA:
29.6		 3fw1A-1qrdA:
41.88
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.
1via SHIKIMATE KINASE

(Campylobacter
jejuni) 		PF01202
(SKI) 		5 PHE A  51
GLY A  82
GLY A  81
THR A  80
ILE A  10
 None
SO4  A 176 (-3.4A)
None
None
None
 1.26A 3fw1A-1viaA:
2.5		 3fw1A-1viaA:
21.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1w8o BACTERIAL SIALIDASE

(Micromonospora
viridifaciens) 		PF00754
(F5_F8_type_C)
PF10633
(NPCBM_assoc)
PF13088
(BNR_2) 		5 GLY A 382
TYR A 393
ASN A 395
GLU A 208
ILE A 315
 None
 1.32A 3fw1A-1w8oA:
undetectable		 3fw1A-1w8oA:
16.94
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.
2hh9 THIAMIN
PYROPHOSPHOKINASE

(Candida
albicans) 		PF04263
(TPK_catalytic)
PF04265
(TPK_B1_binding) 		5 GLY A 306
GLY A 309
THR A 308
TYR A 247
ILE A  19
 None
 1.26A 3fw1A-2hh9A:
undetectable		 3fw1A-2hh9A:
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.
2hru PHOSPHORIBOSYLFORMYL
GLYCINAMIDINE
SYNTHASE II

(Thermotoga
maritima) 		PF00586
(AIRS)
PF02769
(AIRS_C)
PF16904
(PurL_C) 		5 GLY A  90
GLY A  89
THR A  86
TYR A 125
GLU A  70
 None
None
None
None
MG  A 901 ( 2.8A)
 1.24A 3fw1A-2hruA:
undetectable		 3fw1A-2hruA:
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.
2ppy ENOYL-COA HYDRATASE

(Geobacillus
kaustophilus) 		PF00378
(ECH_1) 		5 PHE A  36
GLY A 115
GLY A 116
THR A 112
GLU A 139
 None
 1.05A 3fw1A-2ppyA:
undetectable		 3fw1A-2ppyA:
23.75
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.
2pt5 SHIKIMATE KINASE

(Aquifex
aeolicus) 		PF01202
(SKI) 		5 PHE A  55
GLY A  78
GLY A  77
THR A  76
ILE A   6
 None
 1.49A 3fw1A-2pt5A:
2.9		 3fw1A-2pt5A:
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.
2v5y RECEPTOR-TYPE
TYROSINE-PROTEIN
PHOSPHATASE MU

(Homo sapiens) 		PF00041
(fn3)
PF00047
(ig)
PF00629
(MAM) 		5 PHE A  79
GLY A 246
GLY A 247
THR A 165
GLU A 245
 None
 1.49A 3fw1A-2v5yA:
undetectable		 3fw1A-2v5yA:
15.32
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.
2wtz UDP-N-ACETYLMURAMOYL
-L-ALANYL-D-GLUTAMAT
E--2,6-DIAMINOPIMELA
TE LIGASE

(Mycobacterium
tuberculosis) 		PF01225
(Mur_ligase)
PF02875
(Mur_ligase_C)
PF08245
(Mur_ligase_M) 		5 GLY A 156
TYR A 343
ASN A 344
GLU A 220
ILE A 151
 None
 1.37A 3fw1A-2wtzA:
3.1		 3fw1A-2wtzA:
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.
2wya HYDROXYMETHYLGLUTARY
L-COA SYNTHASE,
MITOCHONDRIAL

(Homo sapiens) 		PF01154
(HMG_CoA_synt_N)
PF08540
(HMG_CoA_synt_C) 		5 PHE A 421
GLY A 169
THR A 383
TYR A 387
GLU A 128
 None
 1.38A 3fw1A-2wyaA:
undetectable		 3fw1A-2wyaA:
19.74
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.
3a24 ALPHA-GALACTOSIDASE

(Bacteroides
thetaiotaomicron) 		PF10566
(Glyco_hydro_97)
PF14508
(GH97_N)
PF14509
(GH97_C) 		5 PHE A 559
GLY A 595
GLY A 594
THR A 583
ILE A 581
 None
 1.18A 3fw1A-3a24A:
undetectable		 3fw1A-3a24A:
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.
3bwq CAPSID PROTEIN VP1

(Macaca mulatta
polyomavirus 1) 		PF00718
(Polyoma_coat) 		5 GLY A 227
GLY A 226
THR A 225
TYR A 224
GLU A 228
 None
 1.17A 3fw1A-3bwqA:
undetectable		 3fw1A-3bwqA:
22.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3d02 PUTATIVE LACI-TYPE
TRANSCRIPTIONAL
REGULATOR

(Klebsiella
pneumoniae) 		PF13407
(Peripla_BP_4) 		5 PHE A 136
GLY A 264
GLY A 245
TYR A 140
ILE A 261
 None
 1.21A 3fw1A-3d02A:
4.0		 3fw1A-3d02A:
20.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3hrd NICOTINATE
DEHYDROGENASE LARGE
MOLYBDOPTERIN
SUBUNIT
NICOTINATE
DEHYDROGENASE MEDIUM
MOLYBDOPTERIN
SUBUNIT

(Eubacterium
barkeri) 		PF01315
(Ald_Xan_dh_C)
PF02738
(Ald_Xan_dh_C2) 		5 PHE A 239
GLY B 227
GLY B 226
THR B 229
ILE B 268
 MCN  B 921 ( 3.6A)
None
None
None
None
 1.34A 3fw1A-3hrdA:
undetectable		 3fw1A-3hrdA:
21.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3lew SUSD-LIKE
CARBOHYDRATE BINDING
PROTEIN

(Bacteroides
vulgatus) 		PF07980
(SusD_RagB)
PF14322
(SusD-like_3) 		5 GLY A 101
GLY A 102
THR A 103
ASN A  59
ILE A  97
 None
None
None
1PE  A  12 (-3.9A)
None
 1.21A 3fw1A-3lewA:
undetectable		 3fw1A-3lewA:
19.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3lew SUSD-LIKE
CARBOHYDRATE BINDING
PROTEIN

(Bacteroides
vulgatus) 		PF07980
(SusD_RagB)
PF14322
(SusD-like_3) 		5 PHE A  88
GLY A 101
GLY A 102
THR A 105
ASN A  63
 None
 1.09A 3fw1A-3lewA:
undetectable		 3fw1A-3lewA:
19.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3mzs CHOLESTEROL
SIDE-CHAIN CLEAVAGE
ENZYME

(Bos taurus) 		PF00067
(p450) 		5 PHE A 203
GLY A 288
GLY A 287
GLU A 432
ILE A 428
 HC9  A 501 (-4.6A)
HEM  A 500 (-3.6A)
HEM  A 500 (-3.4A)
None
None
 1.24A 3fw1A-3mzsA:
undetectable		 3fw1A-3mzsA:
17.89
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.
3n2e SHIKIMATE KINASE

(Helicobacter
pylori) 		PF01202
(SKI) 		5 PHE A  48
GLY A  80
GLY A  79
THR A  78
ILE A   7
 OSA  A1001 (-4.1A)
OSA  A1001 (-3.3A)
None
None
None
 1.35A 3fw1A-3n2eA:
undetectable		 3fw1A-3n2eA:
23.08
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.
3rko NADH-QUINONE
OXIDOREDUCTASE
SUBUNIT L

(Escherichia
coli) 		no annotation 5 PHE L 340
GLY L  96
GLY L  94
THR L  93
ILE L 124
 LFA  L 616 (-4.4A)
None
LFA  L 616 ( 4.1A)
None
None
 1.30A 3fw1A-3rkoL:
undetectable		 3fw1A-3rkoL:
16.78
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.
3s6m PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE

(Burkholderia
pseudomallei) 		PF00160
(Pro_isomerase) 		5 PHE A  27
GLY A  52
GLY A  53
THR A  39
TYR A  36
 None
 1.49A 3fw1A-3s6mA:
undetectable		 3fw1A-3s6mA:
19.23
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.
3s6p CAPSID PROTEIN

(Helicoverpa
armigera stunt
virus) 		PF03566
(Peptidase_A21) 		5 TRP A 304
PHE A 302
GLY A 310
GLY A 311
THR A 312
 None
 1.09A 3fw1A-3s6pA:
undetectable		 3fw1A-3s6pA:
18.02
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3te7 RIBOSYLDIHYDRONICOTI
NAMIDE DEHYDROGENASE
[QUINONE]

(Homo sapiens) 		PF02525
(Flavodoxin_2) 		10 TRP A 105
PHE A 106
GLY A 149
GLY A 150
THR A 151
MET A 154
TYR A 155
ASN A 161
GLU A 193
ILE A 194
 FAD  A 232 ( 4.3A)
FAD  A 232 ( 4.6A)
FAD  A 232 (-3.6A)
FAD  A 232 (-3.6A)
None
None
FAD  A 232 (-4.6A)
None
FAD  A 232 ( 3.1A)
None
 0.23A 3fw1A-3te7A:
39.2		 3fw1A-3te7A:
98.28
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.
3usz EXO-1,3/1,4-BETA-GLU
CANASE

(Pseudoalteromonas
sp. BB1) 		PF00933
(Glyco_hydro_3)
PF01915
(Glyco_hydro_3_C) 		5 TRP A 379
GLY A 142
GLY A 194
THR A 193
ASN A 208
 None
 1.43A 3fw1A-3uszA:
5.2		 3fw1A-3uszA:
14.60
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.
4avo BETA-1,4-EXOCELLULAS
E

(Thermobifida
fusca) 		PF01341
(Glyco_hydro_6) 		5 TRP A 542
PHE A 543
GLY A 498
ASN A 466
GLU A 507
 None
 1.26A 3fw1A-4avoA:
undetectable		 3fw1A-4avoA:
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.
4ecn LEUCINE-RICH REPEAT
PROTEIN

(Bacteroides
thetaiotaomicron) 		PF14660
(DUF4458) 		5 GLY A 242
THR A 273
TYR A 244
ASN A 192
ILE A 275
 None
 1.27A 3fw1A-4ecnA:
undetectable		 3fw1A-4ecnA:
14.61
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4gi5 QUINONE REDUCTASE

(Klebsiella
pneumoniae) 		PF02525
(Flavodoxin_2) 		5 PHE A 103
GLY A 154
GLY A 155
TYR A 160
ASN A 166
 FAD  A 301 (-3.2A)
FAD  A 301 (-3.6A)
FAD  A 301 (-3.5A)
FAD  A 301 (-4.7A)
None
 0.70A 3fw1A-4gi5A:
30.4		 3fw1A-4gi5A:
39.39
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4gi5 QUINONE REDUCTASE

(Klebsiella
pneumoniae) 		PF02525
(Flavodoxin_2) 		5 TRP A 102
GLY A 154
GLY A 155
TYR A 160
ASN A 166
 FAD  A 301 (-4.1A)
FAD  A 301 (-3.6A)
FAD  A 301 (-3.5A)
FAD  A 301 (-4.7A)
None
 0.36A 3fw1A-4gi5A:
30.4		 3fw1A-4gi5A:
39.39
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.
4hea NADH-QUINONE
OXIDOREDUCTASE
SUBUNIT 12

(Thermus
thermophilus) 		PF00361
(Proton_antipo_M)
PF00662
(Proton_antipo_N) 		5 PHE L 327
GLY L  84
GLY L  82
THR L  81
ILE L 112
 None
 1.36A 3fw1A-4heaL:
undetectable		 3fw1A-4heaL:
17.93
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.
4ia4 AQUAPORIN

(Spinacia
oleracea) 		PF00230
(MIP) 		5 TRP A 239
GLY A 150
GLY A 151
ASN A 153
ILE A  60
 None
 1.28A 3fw1A-4ia4A:
undetectable		 3fw1A-4ia4A:
22.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ii0 CRATABL

(Crateva tapia) 		PF00197
(Kunitz_legume) 		5 PHE A 112
GLY A 102
GLY A 103
THR A 104
GLU A  82
 None
None
GOL  A 209 ( 3.7A)
None
None
 1.39A 3fw1A-4ii0A:
undetectable		 3fw1A-4ii0A:
20.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4j9t DESIGNED UNNATURAL
AMINO ACID DEPENDENT
METALLOPROTEIN

(Micromonospora
viridifaciens) 		PF13088
(BNR_2) 		5 GLY A 382
TYR A 393
ASN A 395
GLU A 208
ILE A 315
 None
 1.27A 3fw1A-4j9tA:
undetectable		 3fw1A-4j9tA:
19.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4lg4 SERINE/THREONINE-PRO
TEIN KINASE 3

(Homo sapiens) 		PF00069
(Pkinase) 		5 PHE A 241
GLY A 208
THR A 210
MET A 214
ILE A 147
 None
 1.32A 3fw1A-4lg4A:
undetectable		 3fw1A-4lg4A:
22.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4oig NON-STRUCTURAL
PROTEIN 1, NS1

(Dengue virus) 		PF00948
(Flavi_NS1) 		5 GLY A 248
GLY A 249
MET A 241
ASN A 255
ILE A 224
 None
 1.45A 3fw1A-4oigA:
undetectable		 3fw1A-4oigA:
22.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4q6r SPHINGOSINE-1-PHOSPH
ATE LYASE 1

(Homo sapiens) 		PF00282
(Pyridoxal_deC) 		5 GLY A 398
GLY A 399
TYR A 164
GLU A 185
ILE A 184
 None
 1.06A 3fw1A-4q6rA:
2.1		 3fw1A-4q6rA:
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.
4r6k SOLUTE-BINDING
PROTEIN

(Bacillus
subtilis) 		PF13416
(SBP_bac_8) 		5 PHE A 308
GLY A 320
GLY A 323
GLU A 342
ILE A 345
 None
 1.49A 3fw1A-4r6kA:
undetectable		 3fw1A-4r6kA:
19.85
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.
4wib MAGNESIUM
TRANSPORTER MGTE

(Thermus
thermophilus) 		PF01769
(MgtE) 		5 GLY A 325
GLY A 328
THR A 330
ASN A 332
ILE A 397
 None
 1.27A 3fw1A-4wibA:
undetectable		 3fw1A-4wibA:
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.
5bz4 BETA-KETOTHIOLASE

(Mycolicibacterium
smegmatis) 		PF00108
(Thiolase_N)
PF02803
(Thiolase_C) 		5 PHE A 401
GLY A  93
GLY A 366
THR A 365
MET A 369
 None
 1.44A 3fw1A-5bz4A:
undetectable		 3fw1A-5bz4A:
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.
5es6 LINEAR GRAMICIDIN
SYNTHASE SUBUNIT A

(Brevibacillus
parabrevis) 		PF00501
(AMP-binding)
PF00551
(Formyl_trans_N) 		5 PHE A 448
GLY A 473
THR A 474
TYR A 475
ASN A 453
 None
 1.18A 3fw1A-5es6A:
5.1		 3fw1A-5es6A:
16.16
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.
5jnf LINEAR GRAMICIDIN
SYNTHASE SUBUNIT A

(Brevibacillus
parabrevis) 		no annotation 5 PHE C 448
GLY C 473
THR C 474
TYR C 475
ASN C 453
 None
 1.18A 3fw1A-5jnfC:
5.2		 3fw1A-5jnfC:
17.71
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.
5l56 PLEXIN-A1

(Mus musculus) 		PF01403
(Sema)
PF01437
(PSI)
PF01833
(TIG) 		5 GLY A1223
GLY A1061
THR A1062
ASN A1090
ILE A1057
 None
 1.40A 3fw1A-5l56A:
undetectable		 3fw1A-5l56A:
10.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5l7n PLEXIN-A1

(Mus musculus) 		PF01833
(TIG) 		5 GLY A1223
GLY A1061
THR A1062
ASN A1090
ILE A1057
 None
 1.32A 3fw1A-5l7nA:
undetectable		 3fw1A-5l7nA:
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.
5la7 HEPARANASE

(Homo sapiens) 		PF03662
(Glyco_hydro_79n) 		5 GLY A  95
GLY A  96
THR A  97
ASN A  64
GLU A 221
 None
6S6  A 613 (-3.2A)
6S6  A 613 (-4.1A)
None
None
 1.10A 3fw1A-5la7A:
undetectable		 3fw1A-5la7A:
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.
5n9m COBYRIC ACID
SYNTHASE

(Staphylococcus
aureus) 		no annotation 5 PHE A 120
GLY A 177
THR A 186
TYR A  97
ILE A 135
 None
 1.09A 3fw1A-5n9mA:
3.8		 3fw1A-5n9mA:
15.93
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.
5n9m COBYRIC ACID
SYNTHASE

(Staphylococcus
aureus) 		no annotation 5 PHE A 120
GLY A 177
THR A 186
TYR A  97
ILE A 143
 None
 1.32A 3fw1A-5n9mA:
3.8		 3fw1A-5n9mA:
15.93
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.
5n9m COBYRIC ACID
SYNTHASE

(Staphylococcus
aureus) 		no annotation 5 PHE A 120
GLY A 185
THR A 186
TYR A  97
ILE A 199
 None
 1.42A 3fw1A-5n9mA:
3.8		 3fw1A-5n9mA:
15.93
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.
5um8 GLYCOPROTEIN GP120

(Human
immunodeficiency
virus 1) 		PF00516
(GP120) 		5 GLY G 473
GLY G 472
THR G 257
ASN G 478
ILE G 371
 None
 1.46A 3fw1A-5um8G:
undetectable		 3fw1A-5um8G:
18.98
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.
5x9u THERMOSOME, ALPHA
SUBUNIT

(Carboxydothermus
hydrogenoformans) 		no annotation 5 GLY A 345
GLY A 346
THR A 305
GLU A 344
ILE A 343
 None
 1.29A 3fw1A-5x9uA:
undetectable		 3fw1A-5x9uA:
18.25
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.
6al5 B-LYMPHOCYTE ANTIGEN
CD19

(Homo sapiens) 		no annotation 5 GLY A  92
GLY A  93
THR A 112
TYR A  95
GLU A 120
 None
 1.39A 3fw1A-6al5A:
undetectable		 3fw1A-6al5A:
18.05
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.
6bqc CYCLOPROPANE-FATTY-A
CYL-PHOSPHOLIPID
SYNTHASE

(Escherichia
coli) 		no annotation 5 PHE A  76
GLY A  57
GLY A  59
TYR A 349
GLU A  53
 LOP  A 402 ( 3.8A)
None
None
None
None
 1.50A 3fw1A-6bqcA:
2.3		 3fw1A-6bqcA:
21.08