SIMILAR PATTERNS OF AMINO ACIDS FOR 4BB2_B_STRB1384_1

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.
1a1s ORNITHINE
CARBAMOYLTRANSFERASE

(Pyrococcus
furiosus) 		PF00185
(OTCace)
PF02729
(OTCace_N) 		5 GLN A 301
THR A  59
PHE A  63
ILE A 126
HIS A 134
 None
 1.50A 4bb2A-1a1sA:
undetectable
4bb2B-1a1sA:
undetectable		 4bb2A-1a1sA:
21.43
4bb2B-1a1sA:
6.77
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.
1gr0 INOSITOL-3-PHOSPHATE
SYNTHASE

(Mycobacterium
tuberculosis) 		PF01658
(Inos-1-P_synth) 		5 ALA A 153
SER A 150
PHE A 186
ILE A 176
ASN A 170
 NAD  A1000 ( 4.2A)
None
None
None
None
 1.26A 4bb2A-1gr0A:
0.0
4bb2B-1gr0A:
0.0		 4bb2A-1gr0A:
20.71
4bb2B-1gr0A:
5.72
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.
1h31 DIHEME CYTOCHROME C

(Rhodovulum
sulfidophilum) 		no annotation 5 ALA A 139
SER A 140
ARG A 143
ILE A  14
SER A  33
 None
 1.32A 4bb2A-1h31A:
undetectable
4bb2B-1h31A:
0.0		 4bb2A-1h31A:
20.51
4bb2B-1h31A:
5.79
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.
1qfw ANTIBODY (ANTI BETA
SUBUNIT) (HEAVY
CHAIN)
ANTIBODY (ANTI BETA
SUBUNIT) (LIGHT
CHAIN)

(Mus musculus) 		PF07686
(V-set) 		5 GLN I 299
PHE I 309
ILE I 237
SER I 235
HIS M 294
 None
 1.18A 4bb2A-1qfwI:
undetectable
4bb2B-1qfwI:
0.0		 4bb2A-1qfwI:
16.42
4bb2B-1qfwI:
13.79
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.
1ued P450 MONOOXYGENASE

(Amycolatopsis
orientalis) 		PF00067
(p450) 		5 GLN A  19
PHE A  18
ARG A  41
ILE A  42
SER A  46
 None
 1.15A 4bb2A-1uedA:
0.0
4bb2B-1uedA:
0.0		 4bb2A-1uedA:
23.46
4bb2B-1uedA:
6.85
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.
1woq INORGANIC
POLYPHOSPHATE/ATP-GL
UCOMANNOKINASE

(Arthrobacter
sp. KM) 		PF00480
(ROK) 		5 ALA A 183
SER A 184
PHE A 218
ILE A 147
HIS A 208
 None
 1.12A 4bb2A-1woqA:
0.0
4bb2B-1woqA:
0.0		 4bb2A-1woqA:
22.16
4bb2B-1woqA:
11.06
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.
1zi7 KES1 PROTEIN

(Saccharomyces
cerevisiae) 		PF01237
(Oxysterol_BP) 		5 SER A 193
THR A  92
PHE A  89
ILE A 221
SER A 219
 None
 1.48A 4bb2A-1zi7A:
0.0
4bb2B-1zi7A:
0.0		 4bb2A-1zi7A:
21.11
4bb2B-1zi7A:
6.65
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.
2bht CYSTEINE SYNTHASE B

(Escherichia
coli) 		PF00291
(PALP) 		5 SER A 224
PHE A 169
ILE A 195
SER A 171
HIS A 150
 None
 1.44A 4bb2A-2bhtA:
0.9
4bb2B-2bhtA:
0.0		 4bb2A-2bhtA:
24.12
4bb2B-2bhtA:
8.42
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.
2cgj L-RHAMNULOSE KINASE

(Escherichia
coli) 		PF00370
(FGGY_N)
PF02782
(FGGY_C) 		5 ALA A  13
SER A  14
THR A 181
SER A 235
TRP A  82
 ADP  A1482 ( 4.9A)
ADP  A1482 (-2.4A)
None
None
None
 1.48A 4bb2A-2cgjA:
undetectable
4bb2B-2cgjA:
0.0		 4bb2A-2cgjA:
23.39
4bb2B-2cgjA:
5.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2fx5 LIPASE

(Pseudomonas
mendocina) 		no annotation 5 ALA A  87
GLN A 164
THR A 144
ARG A  91
SER A 160
 None
 1.21A 4bb2A-2fx5A:
undetectable
4bb2B-2fx5A:
undetectable		 4bb2A-2fx5A:
20.29
4bb2B-2fx5A:
11.30
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.
2gd9 HYPOTHETICAL PROTEIN
YYAP

(Bacillus
subtilis) 		PF01872
(RibD_C) 		5 ALA A 127
SER A 128
PHE A 142
ILE A 134
ASN A 135
 PO4  A 190 ( 3.7A)
PO4  A 190 (-2.6A)
None
None
None
 1.37A 4bb2A-2gd9A:
undetectable
4bb2B-2gd9A:
undetectable		 4bb2A-2gd9A:
21.45
4bb2B-2gd9A:
11.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2jj7 HEMOLYSIN II
REGULATORY PROTEIN

(Bacillus cereus) 		PF00440
(TetR_N) 		5 ALA A 179
SER A 178
ILE A 154
SER A 156
HIS A 149
 None
 1.37A 4bb2A-2jj7A:
undetectable
4bb2B-2jj7A:
undetectable		 4bb2A-2jj7A:
17.95
4bb2B-2jj7A:
9.89
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.
2por PORIN

(Rhodobacter
capsulatus) 		PF13609
(Porin_4) 		5 ALA A 132
SER A 133
PHE A  67
ILE A  70
SER A  64
 None
 1.41A 4bb2A-2porA:
undetectable
4bb2B-2porA:
undetectable		 4bb2A-2porA:
23.63
4bb2B-2porA:
11.86
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2v95 CORTICOSTEROID-BINDI
NG GLOBULIN

(Rattus
norvegicus) 		PF00079
(Serpin) 		7 ALA A  13
GLN A 224
THR A 232
PHE A 234
ARG A 252
ILE A 255
TRP A 362
 HCY  A1375 (-3.6A)
HCY  A1375 (-3.5A)
HCY  A1375 ( 4.2A)
HCY  A1375 (-4.8A)
HCY  A1375 (-4.9A)
None
HCY  A1375 (-3.8A)
 0.59A 4bb2A-2v95A:
30.2
4bb2B-2v95A:
undetectable		 4bb2A-2v95A:
56.80
4bb2B-2v95A:
5.95
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2v95 CORTICOSTEROID-BINDI
NG GLOBULIN

(Rattus
norvegicus) 		PF00079
(Serpin) 		5 ALA A  20
GLN A 224
THR A 232
PHE A 234
ILE A 255
 None
HCY  A1375 (-3.5A)
HCY  A1375 ( 4.2A)
HCY  A1375 (-4.8A)
None
 1.40A 4bb2A-2v95A:
30.2
4bb2B-2v95A:
undetectable		 4bb2A-2v95A:
56.80
4bb2B-2v95A:
5.95
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.
3cky 2-HYDROXYMETHYL
GLUTARATE
DEHYDROGENASE

(Eubacterium
barkeri) 		PF03446
(NAD_binding_2)
PF14833
(NAD_binding_11) 		5 ALA A 186
SER A 187
PHE A 232
ILE A 227
SER A 298
 None
 1.44A 4bb2A-3ckyA:
undetectable
4bb2B-3ckyA:
undetectable		 4bb2A-3ckyA:
20.56
4bb2B-3ckyA:
6.85
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.
3ghp CELLULOSOMAL
SCAFFOLDIN ADAPTOR
PROTEIN B

(Acetivibrio
cellulolyticus) 		PF00963
(Cohesin) 		5 ALA A 121
SER A  72
THR A 151
PHE A 153
ARG A 100
 None
 1.17A 4bb2A-3ghpA:
undetectable
4bb2B-3ghpA:
undetectable		 4bb2A-3ghpA:
19.14
4bb2B-3ghpA:
8.56
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.
3kgl CRUCIFERIN

(Brassica napus) 		PF00190
(Cupin_1) 		5 GLN A 163
PHE A 165
ARG A  47
ILE A 175
SER A  67
 None
 1.20A 4bb2A-3kglA:
undetectable
4bb2B-3kglA:
undetectable		 4bb2A-3kglA:
21.09
4bb2B-3kglA:
6.67
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.
3kzw CYTOSOL
AMINOPEPTIDASE

(Staphylococcus
aureus) 		PF00883
(Peptidase_M17)
PF02789
(Peptidase_M17_N) 		5 SER A 159
PHE A  32
ILE A 156
ASN A   6
HIS A  34
 None
 1.47A 4bb2A-3kzwA:
undetectable
4bb2B-3kzwA:
undetectable		 4bb2A-3kzwA:
22.29
4bb2B-3kzwA:
5.76
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.
3llr DNA
(CYTOSINE-5)-METHYLT
RANSFERASE 3A

(Homo sapiens) 		PF00855
(PWWP) 		5 ALA A 102
SER A 103
PHE A  80
ILE A 133
ASN A 129
 None
 1.35A 4bb2A-3llrA:
undetectable
4bb2B-3llrA:
undetectable		 4bb2A-3llrA:
16.81
4bb2B-3llrA:
15.04
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.
3pr2 TRYPTOPHAN SYNTHASE
BETA CHAIN

(Salmonella
enterica) 		PF00291
(PALP) 		5 ALA B 335
SER B 352
GLN B 370
THR B  71
ILE B 228
 None
 1.35A 4bb2A-3pr2B:
undetectable
4bb2B-3pr2B:
undetectable		 4bb2A-3pr2B:
22.33
4bb2B-3pr2B:
5.71
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.
3pvl MYOSIN VIIA ISOFORM
1

(Mus musculus) 		PF00784
(MyTH4) 		5 ALA A1280
SER A1314
THR A1241
ASN A1548
SER A1547
 None
 1.44A 4bb2A-3pvlA:
undetectable
4bb2B-3pvlA:
undetectable		 4bb2A-3pvlA:
20.54
4bb2B-3pvlA:
3.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3pzl AGMATINE
UREOHYDROLASE

(Thermoplasma
volcanium) 		PF00491
(Arginase) 		5 SER A 151
THR A 127
ARG A 165
SER A 178
HIS A 124
 None
None
None
None
MN  A 314 (-3.3A)
 1.37A 4bb2A-3pzlA:
undetectable
4bb2B-3pzlA:
undetectable		 4bb2A-3pzlA:
20.97
4bb2B-3pzlA:
8.37
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.
3tz6 ASPARTATE-SEMIALDEHY
DE DEHYDROGENASE

(Mycobacterium
tuberculosis) 		PF01118
(Semialdhyde_dh)
PF02774
(Semialdhyde_dhC) 		5 ALA A  29
SER A   4
GLN A  16
THR A  20
ILE A   7
 None
 1.34A 4bb2A-3tz6A:
undetectable
4bb2B-3tz6A:
undetectable		 4bb2A-3tz6A:
21.77
4bb2B-3tz6A:
9.95
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.
3zrp SERINE-PYRUVATE
AMINOTRANSFERASE
(AGXT)

(Sulfolobus
solfataricus) 		PF00266
(Aminotran_5) 		5 ALA A 277
SER A 276
PHE A 325
ARG A 279
ILE A 338
 None
 1.49A 4bb2A-3zrpA:
undetectable
4bb2B-3zrpA:
undetectable		 4bb2A-3zrpA:
21.53
4bb2B-3zrpA:
11.52
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.
4asi ACETYL-COA
CARBOXYLASE 1

(Homo sapiens) 		PF01039
(Carboxyl_trans) 		5 ALA A1739
SER A1740
PHE A1642
ARG A1750
ILE A1751
 None
 1.24A 4bb2A-4asiA:
undetectable
4bb2B-4asiA:
undetectable		 4bb2A-4asiA:
18.10
4bb2B-4asiA:
3.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4bhi GAMMA-BUTYROBETAINE
DIOXYGENASE

(Homo sapiens) 		PF02668
(TauD)
PF06155
(DUF971) 		5 SER A 326
GLN A 215
PHE A 340
ILE A 231
HIS A 202
 None
ZN  A 402 ( 4.2A)
None
None
ZN  A 402 ( 3.3A)
 1.46A 4bb2A-4bhiA:
undetectable
4bb2B-4bhiA:
undetectable		 4bb2A-4bhiA:
23.08
4bb2B-4bhiA:
7.42
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.
4c13 UDP-N-ACETYLMURAMOYL
-L-ALANYL-D-GLUTAMAT
E--L-LYSINE LIGASE

(Staphylococcus
aureus) 		PF01225
(Mur_ligase)
PF02875
(Mur_ligase_C)
PF08245
(Mur_ligase_M) 		5 ALA A  41
SER A  42
GLN A  21
THR A  77
ILE A  38
 None
UML  A 598 ( 3.8A)
None
None
None
 1.38A 4bb2A-4c13A:
undetectable
4bb2B-4c13A:
undetectable		 4bb2A-4c13A:
21.61
4bb2B-4c13A:
6.64
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4c41 CORTICOSTEROID-BINDI
NG GLOBULIN

(Homo sapiens) 		PF00079
(Serpin) 		6 ALA A  18
GLN A 232
THR A 240
PHE A 242
ARG A 260
ILE A 263
 None
 1.11A 4bb2A-4c41A:
48.5
4bb2B-4c41A:
undetectable		 4bb2A-4c41A:
93.33
4bb2B-4c41A:
9.12
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4c41 CORTICOSTEROID-BINDI
NG GLOBULIN

(Homo sapiens) 		PF00079
(Serpin) 		8 ALA A  18
GLN A 232
THR A 240
PHE A 242
ILE A 263
ASN A 264
SER A 267
HIS A 368
 None
 0.86A 4bb2A-4c41A:
48.5
4bb2B-4c41A:
undetectable		 4bb2A-4c41A:
93.33
4bb2B-4c41A:
9.12
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.
4cr6 N-ACYLMANNOSAMINE
1-DEHYDROGENASE

(Flavobacterium
sp. 141-8) 		PF13561
(adh_short_C2) 		5 ALA A 146
SER A 145
ARG A 147
ILE A 149
ASN A 192
 None
 1.37A 4bb2A-4cr6A:
undetectable
4bb2B-4cr6A:
undetectable		 4bb2A-4cr6A:
21.70
4bb2B-4cr6A:
9.84
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.
4e6w CLBP PEPTIDASE

(Escherichia
coli) 		PF00144
(Beta-lactamase) 		5 GLN A  70
PHE A  72
ARG A  50
ILE A  47
SER A  44
 None
 1.36A 4bb2A-4e6wA:
undetectable
4bb2B-4e6wA:
undetectable		 4bb2A-4e6wA:
22.25
4bb2B-4e6wA:
9.09
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.
4efh ACTIN-1

(Acanthamoeba
castellanii) 		PF00022
(Actin) 		5 ALA A 135
THR A 129
PHE A  90
ILE A  10
ASN A  12
 None
 1.41A 4bb2A-4efhA:
undetectable
4bb2B-4efhA:
undetectable		 4bb2A-4efhA:
22.33
4bb2B-4efhA:
9.29
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.
4f9z ENDOPLASMIC
RETICULUM RESIDENT
PROTEIN 27

(Homo sapiens) 		no annotation 5 ALA D 129
SER D 133
PHE D  64
ILE D 106
HIS D  76
 None
 1.45A 4bb2A-4f9zD:
undetectable
4bb2B-4f9zD:
undetectable		 4bb2A-4f9zD:
23.01
4bb2B-4f9zD:
13.22
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.
4lrs 4-HYDROXY-2-OXOVALER
ATE ALDOLASE

(Thermomonospora
curvata) 		PF00682
(HMGL-like)
PF07836
(DmpG_comm) 		5 ALA A 230
SER A  18
THR A 249
PHE A 250
ILE A 227
 None
 1.24A 4bb2A-4lrsA:
undetectable
4bb2B-4lrsA:
undetectable		 4bb2A-4lrsA:
21.66
4bb2B-4lrsA:
9.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ndv ALPHA-GALACTOSYL-BIN
DING LECTIN

(Lyophyllum
decastes) 		no annotation 5 ALA A  45
SER A  44
GLN A  63
ILE A  65
SER A  67
 None
 1.34A 4bb2A-4ndvA:
undetectable
4bb2B-4ndvA:
undetectable		 4bb2A-4ndvA:
13.31
4bb2B-4ndvA:
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.
4pd4 CYTOCHROME B

(Saccharomyces
cerevisiae) 		PF00032
(Cytochrom_B_C)
PF00033
(Cytochrome_B) 		5 ALA C 181
THR C 148
ILE C 176
ASN C 173
SER C 172
 None
 1.10A 4bb2A-4pd4C:
undetectable
4bb2B-4pd4C:
undetectable		 4bb2A-4pd4C:
24.32
4bb2B-4pd4C:
11.62
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.
4qi8 LYTIC POLYSACCHARIDE
MONOOXYGENASE

(Neurospora
crassa) 		PF03443
(Glyco_hydro_61) 		5 ALA A 153
SER A 150
ILE A 196
ASN A 197
HIS A  72
 None
None
None
None
CU  A 301 (-3.2A)
 1.15A 4bb2A-4qi8A:
undetectable
4bb2B-4qi8A:
undetectable		 4bb2A-4qi8A:
20.94
4bb2B-4qi8A:
11.43
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.
4wi0 CELLULOSOMAL
SCAFFOLDIN ADAPTOR
PROTEIN B

(Acetivibrio
cellulolyticus) 		PF00963
(Cohesin) 		5 ALA A 114
SER A  65
THR A 144
PHE A 146
ARG A  93
 None
 1.35A 4bb2A-4wi0A:
undetectable
4bb2B-4wi0A:
undetectable		 4bb2A-4wi0A:
17.94
4bb2B-4wi0A:
9.64
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.
4zke SUPERKILLER PROTEIN
7

(Saccharomyces
cerevisiae) 		PF00009
(GTP_EFTU) 		5 GLN A 568
THR A 681
PHE A 715
ILE A 710
HIS A 678
 GLN  A 568 ( 0.6A)
THR  A 681 ( 0.8A)
PHE  A 715 ( 1.3A)
ILE  A 710 ( 0.7A)
HIS  A 678 ( 1.0A)
 1.03A 4bb2A-4zkeA:
undetectable
4bb2B-4zkeA:
undetectable		 4bb2A-4zkeA:
23.00
4bb2B-4zkeA:
5.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5fav CHOLINE
TRIMETHYLAMINE-LYASE

(Desulfovibrio
alaskensis) 		PF01228
(Gly_radical)
PF02901
(PFL-like) 		5 ALA A 385
SER A 386
GLN A 491
THR A 502
ILE A 700
 None
 1.19A 4bb2A-5favA:
undetectable
4bb2B-5favA:
undetectable		 4bb2A-5favA:
19.58
4bb2B-5favA:
3.45
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5hgc SERPIN

(Taeniopygia
guttata) 		PF00079
(Serpin) 		5 ALA A  39
THR A 254
PHE A 256
ILE A 277
SER A 281
 None
HCY  A 501 ( 4.1A)
HCY  A 501 (-4.8A)
HCY  A 501 ( 4.2A)
HCY  A 501 (-3.0A)
 1.35A 4bb2A-5hgcA:
36.1
4bb2B-5hgcA:
undetectable		 4bb2A-5hgcA:
38.99
4bb2B-5hgcA:
5.31
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.
5kzm TRYPTOPHAN SYNTHASE
BETA CHAIN

(Francisella
tularensis) 		PF00291
(PALP) 		5 ALA B 334
SER B 351
GLN B 369
THR B  70
ILE B 227
 None
 1.38A 4bb2A-5kzmB:
undetectable
4bb2B-5kzmB:
undetectable		 4bb2A-5kzmB:
22.28
4bb2B-5kzmB:
6.23
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.
5ohs -

(-) 		no annotation 5 THR A 169
PHE A 188
ILE A 198
SER A 186
HIS A 179
 None
 1.44A 4bb2A-5ohsA:
undetectable
4bb2B-5ohsA:
undetectable		 4bb2A-5ohsA:
undetectable
4bb2B-5ohsA:
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.
5v0i TRYPTOPHAN--TRNA
LIGASE

(Escherichia
coli) 		PF00579
(tRNA-synt_1b) 		5 ALA A 252
SER A 251
THR A  17
ASN A 245
SER A 188
 None
 1.21A 4bb2A-5v0iA:
undetectable
4bb2B-5v0iA:
undetectable		 4bb2A-5v0iA:
21.43
4bb2B-5v0iA:
9.79
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.
5vf3 CAPSID VERTEX
PROTEIN GP24

(Escherichia
virus T4) 		PF07068
(Gp23) 		5 ALA a 274
SER a 275
THR a 270
ILE a  39
SER a 339
 None
 1.27A 4bb2A-5vf3a:
undetectable
4bb2B-5vf3a:
undetectable		 4bb2A-5vf3a:
23.13
4bb2B-5vf3a:
7.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6b0i KINESIN-LIKE PROTEIN
KLP10A

(Drosophila
melanogaster) 		no annotation 5 ALA K 544
SER K 541
THR K 581
ILE K 513
SER K 511
 None
 1.32A 4bb2A-6b0iK:
undetectable
4bb2B-6b0iK:
undetectable		 4bb2A-6b0iK:
12.57
4bb2B-6b0iK:
16.90
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.
6cj7 SERPIN-12

(Manduca sexta) 		no annotation 5 ALA A 158
SER A 309
THR A 112
ILE A 126
ASN A 127
 None
 1.43A 4bb2A-6cj7A:
8.1
4bb2B-6cj7A:
undetectable		 4bb2A-6cj7A:
14.33
4bb2B-6cj7A:
20.59
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.
6eq8 PERIPLASMIC
ALPHA-GALACTOSIDE-BI
NDING PROTEIN

(Agrobacterium
tumefaciens) 		no annotation 5 ALA D 373
SER D 372
PHE D 467
ARG D 387
ILE D 386
 None
 1.47A 4bb2A-6eq8D:
undetectable
4bb2B-6eq8D:
undetectable		 4bb2A-6eq8D:
11.54
4bb2B-6eq8D:
13.16