SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4irl'

List of Similar Pattern of Amino Acids

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 on the DrReposER ID to view details on interfaces and similar patterns of amino acids)
(Click on the view link on the last column to view superposed patterns of amino acids)
Filter list by:
DrReposER ID / Desc. Hit
PDBID
Hit
Macromolecule
Res.
Matches
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.
1A29_A_TFPA154_1
(CALMODULIN)
4irl MALTOSE-BINDING
PERIPLASMIC PROTEIN,
NOVEL PROTEIN
SIMILAR TO
VERTEBRATE GUANYLATE
BINDING PROTEIN
FAMILY

(Danio
rerio;
Escherichia
coli)
5 / 10 GLU A 131
GLU A 132
LEU A 136
MET A 225
LEU A 116
None
1.48A 1a29A-4irlA:
undetectable
1a29A-4irlA:
13.60
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.
1C4D_B_DVAB8_0
(GRAMICIDIN A)
4irl MALTOSE-BINDING
PERIPLASMIC PROTEIN,
NOVEL PROTEIN
SIMILAR TO
VERTEBRATE GUANYLATE
BINDING PROTEIN
FAMILY

(Escherichia
coli;
Danio
rerio)
3 / 3 TRP A 159
VAL A 260
TRP A 341
None
None
MTT  A 501 (-4.0A)
1.30A 1c4dA-4irlA:
undetectable
1c4dB-4irlA:
undetectable
1c4dA-4irlA:
5.21
1c4dB-4irlA:
5.21
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.
1E06_A_IPBA600_0
(ODORANT-BINDING
PROTEIN)
4irl MALTOSE-BINDING
PERIPLASMIC PROTEIN,
NOVEL PROTEIN
SIMILAR TO
VERTEBRATE GUANYLATE
BINDING PROTEIN
FAMILY

(Escherichia
coli;
Danio
rerio)
4 / 6 VAL A   9
VAL A  51
ILE A  61
ASN A 268
None
0.91A 1e06A-4irlA:
undetectable
1e06A-4irlA:
15.60
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.
2DR2_A_TRPA479_0
(TRYPTOPHANYL-TRNA
SYNTHETASE)
4irl MALTOSE-BINDING
PERIPLASMIC PROTEIN,
NOVEL PROTEIN
SIMILAR TO
VERTEBRATE GUANYLATE
BINDING PROTEIN
FAMILY

(Escherichia
coli;
Danio
rerio)
5 / 11 TYR A 100
GLY A  70
GLY A 435
GLN A  73
GLN A 336
None
1.37A 2dr2A-4irlA:
undetectable
2dr2A-4irlA:
22.50
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.
2EJF_A_ADNA2001_1
(235AA LONG
HYPOTHETICAL
BIOTIN--[ACETYL-COA-
CARBOXYLASE] LIGASE)
4irl MALTOSE-BINDING
PERIPLASMIC PROTEIN,
NOVEL PROTEIN
SIMILAR TO
VERTEBRATE GUANYLATE
BINDING PROTEIN
FAMILY

(Danio
rerio;
Escherichia
coli)
4 / 7 GLU A 441
ALA A 339
ASN A 368
ALA A 372
None
1.08A 2ejfA-4irlA:
undetectable
2ejfA-4irlA:
21.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2H42_C_VIAC903_1
(CGMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE)
4irl MALTOSE-BINDING
PERIPLASMIC PROTEIN,
NOVEL PROTEIN
SIMILAR TO
VERTEBRATE GUANYLATE
BINDING PROTEIN
FAMILY

(Danio
rerio;
Escherichia
coli)
5 / 12 LEU A 263
ILE A 109
VAL A  98
LEU A  77
ILE A  80
None
1.10A 2h42C-4irlA:
undetectable
2h42C-4irlA:
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.
2PYM_A_1UNA1001_3
(PROTEASE RETROPEPSIN)
4irl MALTOSE-BINDING
PERIPLASMIC PROTEIN,
NOVEL PROTEIN
SIMILAR TO
VERTEBRATE GUANYLATE
BINDING PROTEIN
FAMILY

(Danio
rerio;
Escherichia
coli)
3 / 3 ASP A 121
ASN A 119
THR A 246
None
None
MLI  A 502 ( 4.9A)
0.72A 2pymB-4irlA:
undetectable
2pymB-4irlA:
12.99
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.
2VE3_A_REAA1445_1
(PUTATIVE CYTOCHROME
P450 120)
4irl MALTOSE-BINDING
PERIPLASMIC PROTEIN,
NOVEL PROTEIN
SIMILAR TO
VERTEBRATE GUANYLATE
BINDING PROTEIN
FAMILY

(Danio
rerio;
Escherichia
coli)
5 / 12 ALA A 265
LEU A 281
PHE A 280
VAL A 294
GLY A  17
None
1.11A 2ve3A-4irlA:
0.3
2ve3A-4irlA:
22.28
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.
2ZGW_A_ADNA1301_1
(BIOTIN--[ACETYL-COA-
CARBOXYLASE] LIGASE)
4irl MALTOSE-BINDING
PERIPLASMIC PROTEIN,
NOVEL PROTEIN
SIMILAR TO
VERTEBRATE GUANYLATE
BINDING PROTEIN
FAMILY

(Danio
rerio;
Escherichia
coli)
4 / 7 GLU A 441
ALA A 339
ASN A 368
ALA A 372
None
1.10A 2zgwA-4irlA:
undetectable
2zgwA-4irlA:
21.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ZGW_B_ADNB1302_1
(BIOTIN--[ACETYL-COA-
CARBOXYLASE] LIGASE)
4irl MALTOSE-BINDING
PERIPLASMIC PROTEIN,
NOVEL PROTEIN
SIMILAR TO
VERTEBRATE GUANYLATE
BINDING PROTEIN
FAMILY

(Danio
rerio;
Escherichia
coli)
4 / 6 GLU A 441
ALA A 339
ASN A 368
ALA A 372
None
1.10A 2zgwB-4irlA:
undetectable
2zgwB-4irlA:
21.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ZW9_A_SAMA801_1
(LEUCINE CARBOXYL
METHYLTRANSFERASE 2)
4irl MALTOSE-BINDING
PERIPLASMIC PROTEIN,
NOVEL PROTEIN
SIMILAR TO
VERTEBRATE GUANYLATE
BINDING PROTEIN
FAMILY

(Escherichia
coli;
Danio
rerio)
4 / 8 THR A  94
LEU A 286
ASP A 288
GLU A 112
None
None
None
MTT  A 501 (-2.9A)
1.07A 2zw9A-4irlA:
undetectable
2zw9A-4irlA:
21.09
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.
3A35_A_RBFA191_1
(LUMAZINE PROTEIN)
4irl MALTOSE-BINDING
PERIPLASMIC PROTEIN,
NOVEL PROTEIN
SIMILAR TO
VERTEBRATE GUANYLATE
BINDING PROTEIN
FAMILY

(Danio
rerio;
Escherichia
coli)
5 / 12 LEU A 193
THR A 194
ALA A 347
THR A 346
ILE A 349
None
1.21A 3a35A-4irlA:
undetectable
3a35A-4irlA:
17.95
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.
3BGD_A_PM6A301_1
(THIOPURINE
S-METHYLTRANSFERASE)
4irl MALTOSE-BINDING
PERIPLASMIC PROTEIN,
NOVEL PROTEIN
SIMILAR TO
VERTEBRATE GUANYLATE
BINDING PROTEIN
FAMILY

(Danio
rerio;
Escherichia
coli)
4 / 6 PHE A 259
ALA A 163
LEU A 248
PRO A 160
None
1.00A 3bgdA-4irlA:
undetectable
3bgdA-4irlA:
20.87
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.
3BJW_C_SVRC507_1
(PHOSPHOLIPASE A2)
4irl MALTOSE-BINDING
PERIPLASMIC PROTEIN,
NOVEL PROTEIN
SIMILAR TO
VERTEBRATE GUANYLATE
BINDING PROTEIN
FAMILY

(Danio
rerio;
Escherichia
coli)
4 / 7 VAL A 111
GLY A 301
PRO A 230
LYS A 306
None
0.68A 3bjwC-4irlA:
undetectable
3bjwC-4irlA:
14.83
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.
3BJW_G_SVRG506_1
(PHOSPHOLIPASE A2)
4irl MALTOSE-BINDING
PERIPLASMIC PROTEIN,
NOVEL PROTEIN
SIMILAR TO
VERTEBRATE GUANYLATE
BINDING PROTEIN
FAMILY

(Danio
rerio;
Escherichia
coli)
4 / 8 VAL A 111
GLY A 301
PRO A 230
LYS A 306
None
0.91A 3bjwA-4irlA:
undetectable
3bjwA-4irlA:
14.83
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.
3GV1_A_BEZA302_0
(DISULFIDE
INTERCHANGE PROTEIN)
4irl MALTOSE-BINDING
PERIPLASMIC PROTEIN,
NOVEL PROTEIN
SIMILAR TO
VERTEBRATE GUANYLATE
BINDING PROTEIN
FAMILY

(Escherichia
coli;
Danio
rerio)
4 / 6 PRO A 127
LEU A 148
ALA A 224
PRO A 126
None
1.33A 3gv1A-4irlA:
undetectable
3gv1C-4irlA:
undetectable
3gv1A-4irlA:
15.97
3gv1C-4irlA:
15.97
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.
3GV1_B_BEZB301_0
(DISULFIDE
INTERCHANGE PROTEIN)
4irl MALTOSE-BINDING
PERIPLASMIC PROTEIN,
NOVEL PROTEIN
SIMILAR TO
VERTEBRATE GUANYLATE
BINDING PROTEIN
FAMILY

(Escherichia
coli;
Danio
rerio)
4 / 6 LEU A 148
ALA A 224
PRO A 126
PRO A 127
None
1.32A 3gv1A-4irlA:
undetectable
3gv1B-4irlA:
undetectable
3gv1A-4irlA:
15.97
3gv1B-4irlA:
15.97
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.
3HS6_A_EPAA1_1
(PROSTAGLANDIN G/H
SYNTHASE 2)
4irl MALTOSE-BINDING
PERIPLASMIC PROTEIN,
NOVEL PROTEIN
SIMILAR TO
VERTEBRATE GUANYLATE
BINDING PROTEIN
FAMILY

(Danio
rerio;
Escherichia
coli)
5 / 12 VAL A 344
GLY A 188
ALA A 189
LEU A 193
LEU A 161
None
1.05A 3hs6A-4irlA:
undetectable
3hs6A-4irlA:
20.62
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3JYR_A_ACRA371_1
(MALTOSE-BINDING
PERIPLASMIC PROTEIN)
4irl MALTOSE-BINDING
PERIPLASMIC PROTEIN,
NOVEL PROTEIN
SIMILAR TO
VERTEBRATE GUANYLATE
BINDING PROTEIN
FAMILY

(Danio
rerio;
Escherichia
coli)
12 / 12 ASP A  15
LYS A  16
LYS A  43
GLU A  45
GLU A  46
ALA A  64
ASP A  66
ARG A  67
GLU A 112
PRO A 155
TRP A 231
TYR A 342
MTT  A 501 (-3.0A)
MTT  A 501 (-2.8A)
MTT  A 501 (-3.8A)
MTT  A 501 (-2.9A)
MTT  A 501 (-3.5A)
MTT  A 501 (-3.4A)
MTT  A 501 (-2.8A)
MTT  A 501 (-3.8A)
MTT  A 501 (-2.9A)
MTT  A 501 (-3.6A)
MTT  A 501 (-4.4A)
MTT  A 501 (-4.4A)
0.20A 3jyrA-4irlA:
62.9
3jyrA-4irlA:
77.01
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3JYR_A_ACRA371_2
(MALTOSE-BINDING
PERIPLASMIC PROTEIN)
4irl MALTOSE-BINDING
PERIPLASMIC PROTEIN,
NOVEL PROTEIN
SIMILAR TO
VERTEBRATE GUANYLATE
BINDING PROTEIN
FAMILY

(Danio
rerio;
Escherichia
coli)
7 / 7 ASN A  13
TRP A  63
GLU A 154
TYR A 156
MET A 331
TRP A 341
ARG A 345
MTT  A 501 ( 4.8A)
MTT  A 501 (-4.4A)
MTT  A 501 (-3.5A)
MTT  A 501 (-3.8A)
MTT  A 501 ( 4.5A)
MTT  A 501 (-4.0A)
MTT  A 501 (-4.0A)
0.15A 3jyrA-4irlA:
62.9
3jyrA-4irlA:
77.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3N8Y_B_DIFB585_1
(PROSTAGLANDIN G/H
SYNTHASE 1)
4irl MALTOSE-BINDING
PERIPLASMIC PROTEIN,
NOVEL PROTEIN
SIMILAR TO
VERTEBRATE GUANYLATE
BINDING PROTEIN
FAMILY

(Danio
rerio;
Escherichia
coli)
5 / 12 VAL A 197
LEU A 161
GLY A 188
ALA A 189
LEU A 362
None
0.99A 3n8yB-4irlA:
1.1
3n8yB-4irlA:
19.97
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.
3TBG_B_RTZB1_1
(CYTOCHROME P450 2D6)
4irl MALTOSE-BINDING
PERIPLASMIC PROTEIN,
NOVEL PROTEIN
SIMILAR TO
VERTEBRATE GUANYLATE
BINDING PROTEIN
FAMILY

(Danio
rerio;
Escherichia
coli)
5 / 12 PHE A 157
GLY A 301
LEU A 300
GLU A 112
ALA A 232
None
None
None
MTT  A 501 (-2.9A)
None
0.84A 3tbgB-4irlA:
undetectable
3tbgB-4irlA:
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.
3TBG_D_RTZD1_1
(CYTOCHROME P450 2D6)
4irl MALTOSE-BINDING
PERIPLASMIC PROTEIN,
NOVEL PROTEIN
SIMILAR TO
VERTEBRATE GUANYLATE
BINDING PROTEIN
FAMILY

(Danio
rerio;
Escherichia
coli)
5 / 12 PHE A 157
GLY A 301
LEU A 300
GLU A 112
ALA A 232
None
None
None
MTT  A 501 (-2.9A)
None
0.82A 3tbgD-4irlA:
undetectable
3tbgD-4irlA:
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.
3VWQ_A_ACAA601_1
(6-AMINOHEXANOATE-DIM
ER HYDROLASE)
4irl MALTOSE-BINDING
PERIPLASMIC PROTEIN,
NOVEL PROTEIN
SIMILAR TO
VERTEBRATE GUANYLATE
BINDING PROTEIN
FAMILY

(Danio
rerio;
Escherichia
coli)
5 / 12 ALA A 232
TYR A  18
TYR A 211
ASN A 235
GLY A 229
None
1.29A 3vwqA-4irlA:
undetectable
3vwqA-4irlA:
21.11
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.
3VYW_D_SAMD401_1
(MNMC2)
4irl MALTOSE-BINDING
PERIPLASMIC PROTEIN,
NOVEL PROTEIN
SIMILAR TO
VERTEBRATE GUANYLATE
BINDING PROTEIN
FAMILY

(Escherichia
coli;
Danio
rerio)
4 / 5 GLU A 309
ASP A 315
ASP A 288
ASN A 295
None
1.33A 3vywD-4irlA:
undetectable
3vywD-4irlA:
21.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3W9T_B_W9TB501_1
(HEMOLYTIC LECTIN
CEL-III)
4irl MALTOSE-BINDING
PERIPLASMIC PROTEIN,
NOVEL PROTEIN
SIMILAR TO
VERTEBRATE GUANYLATE
BINDING PROTEIN
FAMILY

(Danio
rerio;
Escherichia
coli)
4 / 5 ASP A 432
SER A 433
GLY A 434
ASP A 380
None
1.36A 3w9tB-4irlA:
undetectable
3w9tB-4irlA:
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.
4M2X_G_TMQG202_1
(DIHYDROFOLATE
REDUCTASE)
4irl MALTOSE-BINDING
PERIPLASMIC PROTEIN,
NOVEL PROTEIN
SIMILAR TO
VERTEBRATE GUANYLATE
BINDING PROTEIN
FAMILY

(Danio
rerio;
Escherichia
coli)
5 / 12 ILE A 267
ALA A 106
LEU A  21
VAL A  24
ILE A  60
None
1.09A 4m2xG-4irlA:
undetectable
4m2xG-4irlA:
17.46
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.
4N48_A_SAMA601_1
(CAP-SPECIFIC MRNA
(NUCLEOSIDE-2'-O-)-M
ETHYLTRANSFERASE 1)
4irl MALTOSE-BINDING
PERIPLASMIC PROTEIN,
NOVEL PROTEIN
SIMILAR TO
VERTEBRATE GUANYLATE
BINDING PROTEIN
FAMILY

(Escherichia
coli;
Danio
rerio)
4 / 5 ASN A 268
ALA A  52
GLY A  57
ASP A  15
None
None
None
MTT  A 501 (-3.0A)
0.94A 4n48A-4irlA:
undetectable
4n48A-4irlA:
20.68
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.
4OLT_A_GCSA306_1
(CHITOSANASE)
4irl MALTOSE-BINDING
PERIPLASMIC PROTEIN,
NOVEL PROTEIN
SIMILAR TO
VERTEBRATE GUANYLATE
BINDING PROTEIN
FAMILY

(Danio
rerio;
Escherichia
coli)
3 / 3 SER A  74
ASP A 380
GLN A 336
None
0.78A 4oltA-4irlA:
undetectable
4oltB-4irlA:
undetectable
4oltA-4irlA:
21.41
4oltB-4irlA:
21.41
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.
4OR0_B_NPSB602_1
(SERUM ALBUMIN)
4irl MALTOSE-BINDING
PERIPLASMIC PROTEIN,
NOVEL PROTEIN
SIMILAR TO
VERTEBRATE GUANYLATE
BINDING PROTEIN
FAMILY

(Danio
rerio;
Escherichia
coli)
5 / 9 ALA A 265
ALA A 106
LEU A 104
LEU A 263
VAL A 262
None
1.15A 4or0B-4irlA:
undetectable
4or0B-4irlA:
23.66
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.
4P6X_A_HCYA900_1
(GLUCOCORTICOID
RECEPTOR)
4irl MALTOSE-BINDING
PERIPLASMIC PROTEIN,
NOVEL PROTEIN
SIMILAR TO
VERTEBRATE GUANYLATE
BINDING PROTEIN
FAMILY

(Danio
rerio;
Escherichia
coli)
5 / 12 LEU A  76
GLY A  70
ARG A 383
ILE A  61
PHE A  68
None
1.46A 4p6xA-4irlA:
undetectable
4p6xA-4irlA:
19.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4P6X_E_HCYE900_1
(GLUCOCORTICOID
RECEPTOR)
4irl MALTOSE-BINDING
PERIPLASMIC PROTEIN,
NOVEL PROTEIN
SIMILAR TO
VERTEBRATE GUANYLATE
BINDING PROTEIN
FAMILY

(Danio
rerio;
Escherichia
coli)
5 / 12 LEU A  76
GLY A  70
ARG A 383
ILE A  61
PHE A  68
None
1.47A 4p6xE-4irlA:
undetectable
4p6xE-4irlA:
19.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4P6X_I_HCYI900_1
(GLUCOCORTICOID
RECEPTOR)
4irl MALTOSE-BINDING
PERIPLASMIC PROTEIN,
NOVEL PROTEIN
SIMILAR TO
VERTEBRATE GUANYLATE
BINDING PROTEIN
FAMILY

(Danio
rerio;
Escherichia
coli)
5 / 12 LEU A  76
GLY A  70
ARG A 383
ILE A  61
PHE A  68
None
1.42A 4p6xI-4irlA:
undetectable
4p6xI-4irlA:
19.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4QWP_B_GCSB304_1
(CHITOSANASE)
4irl MALTOSE-BINDING
PERIPLASMIC PROTEIN,
NOVEL PROTEIN
SIMILAR TO
VERTEBRATE GUANYLATE
BINDING PROTEIN
FAMILY

(Danio
rerio;
Escherichia
coli)
3 / 3 GLN A 336
SER A  74
ASP A 380
None
0.78A 4qwpA-4irlA:
undetectable
4qwpB-4irlA:
undetectable
4qwpA-4irlA:
21.41
4qwpB-4irlA:
21.41
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.
5HWA_A_GCSA302_1
(CHITOSANASE)
4irl MALTOSE-BINDING
PERIPLASMIC PROTEIN,
NOVEL PROTEIN
SIMILAR TO
VERTEBRATE GUANYLATE
BINDING PROTEIN
FAMILY

(Danio
rerio;
Escherichia
coli)
4 / 7 ASP A 380
ASP A 432
GLY A  70
TYR A 100
None
1.02A 5hwaA-4irlA:
undetectable
5hwaA-4irlA:
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.
5IEO_A_VDYA206_1
(CDL2.3A)
4irl MALTOSE-BINDING
PERIPLASMIC PROTEIN,
NOVEL PROTEIN
SIMILAR TO
VERTEBRATE GUANYLATE
BINDING PROTEIN
FAMILY

(Danio
rerio;
Escherichia
coli)
5 / 12 LEU A 431
PHE A 442
LEU A 453
LEU A 457
PHE A 428
None
1.22A 5ieoA-4irlA:
undetectable
5ieoA-4irlA:
13.36
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.
5NM5_B_LOCB502_1
(TUBULIN ALPHA-1B
CHAIN
TUBULIN BETA-2B
CHAIN)
4irl MALTOSE-BINDING
PERIPLASMIC PROTEIN,
NOVEL PROTEIN
SIMILAR TO
VERTEBRATE GUANYLATE
BINDING PROTEIN
FAMILY

(Danio
rerio;
Escherichia
coli)
4 / 4 ASN A 368
SER A 338
ALA A 343
VAL A 344
None
1.38A 5nm5A-4irlA:
undetectable
5nm5A-4irlA:
22.24
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.
5W4Z_A_RBFA502_1
(RIBOFLAVIN LYASE)
4irl MALTOSE-BINDING
PERIPLASMIC PROTEIN,
NOVEL PROTEIN
SIMILAR TO
VERTEBRATE GUANYLATE
BINDING PROTEIN
FAMILY

(Danio
rerio;
Escherichia
coli)
6 / 12 ALA A 343
ALA A 339
GLY A 167
ALA A 189
PHE A 170
VAL A 182
None
1.39A 5w4zA-4irlA:
undetectable
5w4zA-4irlA:
11.31
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.
5W4Z_B_RBFB502_1
(RIBOFLAVIN LYASE)
4irl MALTOSE-BINDING
PERIPLASMIC PROTEIN,
NOVEL PROTEIN
SIMILAR TO
VERTEBRATE GUANYLATE
BINDING PROTEIN
FAMILY

(Danio
rerio;
Escherichia
coli)
6 / 12 ALA A 343
ALA A 339
GLY A 167
ALA A 189
PHE A 170
VAL A 182
None
1.41A 5w4zB-4irlA:
undetectable
5w4zB-4irlA:
11.31
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.
6B58_A_ACTA603_0
(FUMARATE REDUCTASE
FLAVOPROTEIN SUBUNIT)
4irl MALTOSE-BINDING
PERIPLASMIC PROTEIN,
NOVEL PROTEIN
SIMILAR TO
VERTEBRATE GUANYLATE
BINDING PROTEIN
FAMILY

(Escherichia
coli;
Danio
rerio)
3 / 3 TYR A 156
ASN A 228
LEU A 114
MTT  A 501 (-3.8A)
None
None
0.84A 6b58A-4irlA:
undetectable
6b58A-4irlA:
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.
6BM5_A_SAMA1301_0
(METHIONINE SYNTHASE)
4irl MALTOSE-BINDING
PERIPLASMIC PROTEIN,
NOVEL PROTEIN
SIMILAR TO
VERTEBRATE GUANYLATE
BINDING PROTEIN
FAMILY

(Escherichia
coli;
Danio
rerio)
5 / 11 PRO A 134
GLU A 131
PRO A 255
ALA A 164
PRO A 160
None
1.43A 6bm5A-4irlA:
undetectable
6bm5A-4irlA:
22.83