SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4aie'

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.
1C4D_B_DVAB8_0
(GRAMICIDIN A)		 4aie GLUCAN
1,6-ALPHA-GLUCOSIDAS
E
(Lactobacillus
acidophilus) 		3 / 3 TRP A 307
VAL A   9
TRP A   5
 None
 1.06A 1c4dA-4aieA:
undetectable
1c4dB-4aieA:
undetectable		 1c4dA-4aieA:
2.68
1c4dB-4aieA:
2.68
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.
1DED_B_QPSB1501_1
(CYCLODEXTRIN
GLUCANOTRANSFERASE)		 4aie GLUCAN
1,6-ALPHA-GLUCOSIDAS
E
(Lactobacillus
acidophilus) 		7 / 12 TYR A  62
ARG A 196
ASP A 198
GLU A 240
HIS A 315
ASP A 316
ARG A 405
 GOL  A1542 (-3.6A)
GOL  A1542 ( 4.4A)
GOL  A1542 (-2.7A)
GOL  A1542 ( 3.6A)
None
GOL  A1548 (-3.5A)
None
 0.80A 1dedB-4aieA:
29.7		 1dedB-4aieA:
25.20
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.
1E7B_A_HLTA4001_1
(SERUM ALBUMIN)		 4aie GLUCAN
1,6-ALPHA-GLUCOSIDAS
E
(Lactobacillus
acidophilus) 		4 / 5 ARG A 405
ALA A 404
ASP A 372
GLY A 400
 None
 1.18A 1e7bA-4aieA:
undetectable		 1e7bA-4aieA:
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.
1GS4_A_ZK5A1918_1
(ANDROGEN RECEPTOR)		 4aie GLUCAN
1,6-ALPHA-GLUCOSIDAS
E
(Lactobacillus
acidophilus) 		5 / 12 LEU A  39
LEU A  42
GLY A  43
VAL A  10
ALA A  87
 None
 1.08A 1gs4A-4aieA:
undetectable		 1gs4A-4aieA:
18.73
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.
1MXD_A_ACRA735_1
(ALPHA AMYLASE)		 4aie GLUCAN
1,6-ALPHA-GLUCOSIDAS
E
(Lactobacillus
acidophilus) 		8 / 12 TYR A  62
HIS A 102
PHE A 162
ARG A 196
ASP A 198
GLU A 240
HIS A 315
ASP A 316
 GOL  A1542 (-3.6A)
GOL  A1542 (-3.0A)
GOL  A1542 (-3.2A)
GOL  A1542 ( 4.4A)
GOL  A1542 (-2.7A)
GOL  A1542 ( 3.6A)
None
GOL  A1548 (-3.5A)
 0.96A 1mxdA-4aieA:
24.2		 1mxdA-4aieA:
24.77
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.
1NBH_A_SAMA293_1
(GLYCINE
N-METHYLTRANSFERASE)		 4aie GLUCAN
1,6-ALPHA-GLUCOSIDAS
E
(Lactobacillus
acidophilus) 		3 / 3 ARG A 382
ASP A 272
ASN A 268
 None
 0.90A 1nbhA-4aieA:
undetectable		 1nbhA-4aieA:
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.
1NBH_D_SAMD3293_1
(GLYCINE
N-METHYLTRANSFERASE)		 4aie GLUCAN
1,6-ALPHA-GLUCOSIDAS
E
(Lactobacillus
acidophilus) 		3 / 3 ARG A 382
ASP A 272
ASN A 268
 None
 0.89A 1nbhD-4aieA:
undetectable		 1nbhD-4aieA:
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.
1ZGY_A_BRLA503_2
(PEROXISOME
PROLIFERATOR
ACTIVATED RECEPTOR
GAMMA)		 4aie GLUCAN
1,6-ALPHA-GLUCOSIDAS
E
(Lactobacillus
acidophilus) 		4 / 5 ILE A  44
ILE A 357
MET A 359
LEU A  49
 None
 0.86A 1zgyA-4aieA:
undetectable		 1zgyA-4aieA:
20.70
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.
2C12_C_SPMC1434_1
(NITROALKANE OXIDASE)		 4aie GLUCAN
1,6-ALPHA-GLUCOSIDAS
E
(Lactobacillus
acidophilus) 		5 / 12 MET A 345
LEU A 294
VAL A 493
LEU A 479
VAL A 478
 None
 1.21A 2c12C-4aieA:
undetectable		 2c12C-4aieA:
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.
2C12_C_SPMC1434_1
(NITROALKANE OXIDASE)		 4aie GLUCAN
1,6-ALPHA-GLUCOSIDAS
E
(Lactobacillus
acidophilus) 		5 / 12 MET A 345
LEU A 294
VAL A 493
MET A 337
LEU A 479
 None
 1.17A 2c12C-4aieA:
undetectable		 2c12C-4aieA:
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.
2HA6_A_SCKA902_1
(ACETYLCHOLINESTERASE)		 4aie GLUCAN
1,6-ALPHA-GLUCOSIDAS
E
(Lactobacillus
acidophilus) 		5 / 10 ASN A 314
GLU A 356
LEU A  42
LEU A  39
TYR A  38
 None
 1.28A 2ha6A-4aieA:
undetectable		 2ha6A-4aieA:
21.00
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.
2HA6_B_SCKB952_1
(ACETYLCHOLINESTERASE)		 4aie GLUCAN
1,6-ALPHA-GLUCOSIDAS
E
(Lactobacillus
acidophilus) 		5 / 10 ASN A 314
GLU A 356
LEU A  42
LEU A  39
TYR A  38
 None
 1.26A 2ha6B-4aieA:
undetectable		 2ha6B-4aieA:
21.00
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.
2J2P_E_SC2E1289_1
(FICOLIN-2)		 4aie GLUCAN
1,6-ALPHA-GLUCOSIDAS
E
(Lactobacillus
acidophilus) 		4 / 6 ASP A 316
ARG A 401
ASP A 402
ASP A  59
 GOL  A1548 (-3.5A)
GOL  A1542 ( 3.1A)
None
GOL  A1542 (-2.1A)
 1.27A 2j2pE-4aieA:
undetectable
2j2pF-4aieA:
undetectable		 2j2pE-4aieA:
16.39
2j2pF-4aieA:
16.39
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.
2JKJ_D_CLMD1142_0
(DR HEMAGGLUTININ
STRUCTURAL SUBUNIT)		 4aie GLUCAN
1,6-ALPHA-GLUCOSIDAS
E
(Lactobacillus
acidophilus) 		4 / 5 PRO A 220
PRO A 216
GLY A 204
TYR A 221
 None
 1.08A 2jkjD-4aieA:
undetectable		 2jkjD-4aieA:
13.11
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.
2JKJ_F_CLMF1143_0
(DR HEMAGGLUTININ
STRUCTURAL SUBUNIT)		 4aie GLUCAN
1,6-ALPHA-GLUCOSIDAS
E
(Lactobacillus
acidophilus) 		4 / 5 PRO A 220
PRO A 216
GLY A 204
TYR A 221
 None
 1.07A 2jkjF-4aieA:
undetectable		 2jkjF-4aieA:
13.11
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.
2RCT_A_RTLA140_1
(RETINOL-BINDING
PROTEIN II, CELLULAR)		 4aie GLUCAN
1,6-ALPHA-GLUCOSIDAS
E
(Lactobacillus
acidophilus) 		3 / 3 GLN A  54
THR A 103
TRP A 109
 None
 0.97A 2rctA-4aieA:
undetectable		 2rctA-4aieA:
13.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2Y00_A_Y00A601_2
(BETA-1 ADRENERGIC
RECEPTOR)		 4aie GLUCAN
1,6-ALPHA-GLUCOSIDAS
E
(Lactobacillus
acidophilus) 		4 / 4 VAL A 100
PHE A 230
VAL A  95
TRP A  48
 None
 1.19A 2y00A-4aieA:
0.1		 2y00A-4aieA:
20.25
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.
2ZZM_A_SAMA401_1
(UNCHARACTERIZED
PROTEIN MJ0883)		 4aie GLUCAN
1,6-ALPHA-GLUCOSIDAS
E
(Lactobacillus
acidophilus) 		3 / 3 ARG A 177
ASP A 206
ASN A 170
 None
 0.85A 2zzmA-4aieA:
undetectable		 2zzmA-4aieA:
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.
3AIC_A_ACRA5044_1
(GLUCOSYLTRANSFERASE-
SI)		 4aie GLUCAN
1,6-ALPHA-GLUCOSIDAS
E
(Lactobacillus
acidophilus) 		6 / 12 ARG A 196
ASP A 198
GLU A 240
HIS A 315
ASP A 316
ASP A  59
 GOL  A1542 ( 4.4A)
GOL  A1542 (-2.7A)
GOL  A1542 ( 3.6A)
None
GOL  A1548 (-3.5A)
GOL  A1542 (-2.1A)
 0.68A 3aicA-4aieA:
3.3		 3aicA-4aieA:
20.25
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.
3AIC_B_ACRB5044_1
(GLUCOSYLTRANSFERASE-
SI)		 4aie GLUCAN
1,6-ALPHA-GLUCOSIDAS
E
(Lactobacillus
acidophilus) 		6 / 12 ARG A 196
ASP A 198
GLU A 240
HIS A 315
ASP A 316
ASP A  59
 GOL  A1542 ( 4.4A)
GOL  A1542 (-2.7A)
GOL  A1542 ( 3.6A)
None
GOL  A1548 (-3.5A)
GOL  A1542 (-2.1A)
 0.69A 3aicB-4aieA:
4.4		 3aicB-4aieA:
20.25
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.
3AIC_B_ACRB5044_1
(GLUCOSYLTRANSFERASE-
SI)		 4aie GLUCAN
1,6-ALPHA-GLUCOSIDAS
E
(Lactobacillus
acidophilus) 		6 / 12 ARG A 196
ASP A 198
GLU A 240
HIS A 315
ASP A 316
GLN A 166
 GOL  A1542 ( 4.4A)
GOL  A1542 (-2.7A)
GOL  A1542 ( 3.6A)
None
GOL  A1548 (-3.5A)
GOL  A1542 ( 3.5A)
 0.89A 3aicB-4aieA:
4.4		 3aicB-4aieA:
20.25
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.
3AIC_C_ACRC5044_1
(GLUCOSYLTRANSFERASE-
SI)		 4aie GLUCAN
1,6-ALPHA-GLUCOSIDAS
E
(Lactobacillus
acidophilus) 		7 / 12 ARG A 196
ASP A 198
GLU A 240
HIS A 315
ASP A 316
ASP A  59
TYR A  62
 GOL  A1542 ( 4.4A)
GOL  A1542 (-2.7A)
GOL  A1542 ( 3.6A)
None
GOL  A1548 (-3.5A)
GOL  A1542 (-2.1A)
GOL  A1542 (-3.6A)
 0.68A 3aicC-4aieA:
4.0		 3aicC-4aieA:
20.25
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.
3AIC_C_ACRC5044_1
(GLUCOSYLTRANSFERASE-
SI)		 4aie GLUCAN
1,6-ALPHA-GLUCOSIDAS
E
(Lactobacillus
acidophilus) 		6 / 12 ARG A 196
GLU A 240
HIS A 315
ASP A 316
TYR A  62
GLN A 166
 GOL  A1542 ( 4.4A)
GOL  A1542 ( 3.6A)
None
GOL  A1548 (-3.5A)
GOL  A1542 (-3.6A)
GOL  A1542 ( 3.5A)
 0.96A 3aicC-4aieA:
4.0		 3aicC-4aieA:
20.25
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.
3AIC_D_ACRD5044_1
(GLUCOSYLTRANSFERASE-
SI)		 4aie GLUCAN
1,6-ALPHA-GLUCOSIDAS
E
(Lactobacillus
acidophilus) 		6 / 12 ARG A 196
ASP A 198
GLU A 240
HIS A 315
ASP A 316
ASP A  59
 GOL  A1542 ( 4.4A)
GOL  A1542 (-2.7A)
GOL  A1542 ( 3.6A)
None
GOL  A1548 (-3.5A)
GOL  A1542 (-2.1A)
 0.74A 3aicD-4aieA:
3.5		 3aicD-4aieA:
20.25
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.
3AIC_E_ACRE5044_1
(GLUCOSYLTRANSFERASE-
SI)		 4aie GLUCAN
1,6-ALPHA-GLUCOSIDAS
E
(Lactobacillus
acidophilus) 		6 / 12 ARG A 196
ASP A 198
GLU A 240
HIS A 315
ASP A 316
ASP A  59
 GOL  A1542 ( 4.4A)
GOL  A1542 (-2.7A)
GOL  A1542 ( 3.6A)
None
GOL  A1548 (-3.5A)
GOL  A1542 (-2.1A)
 0.73A 3aicE-4aieA:
2.3		 3aicE-4aieA:
20.25
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.
3AIC_F_ACRF5044_1
(GLUCOSYLTRANSFERASE-
SI)		 4aie GLUCAN
1,6-ALPHA-GLUCOSIDAS
E
(Lactobacillus
acidophilus) 		6 / 12 ARG A 196
ASP A 198
GLU A 240
HIS A 315
ASP A 316
ASP A  59
 GOL  A1542 ( 4.4A)
GOL  A1542 (-2.7A)
GOL  A1542 ( 3.6A)
None
GOL  A1548 (-3.5A)
GOL  A1542 (-2.1A)
 0.72A 3aicF-4aieA:
3.5		 3aicF-4aieA:
20.25
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.
3AIC_F_ACRF5044_1
(GLUCOSYLTRANSFERASE-
SI)		 4aie GLUCAN
1,6-ALPHA-GLUCOSIDAS
E
(Lactobacillus
acidophilus) 		5 / 12 ARG A 196
GLU A 240
HIS A 315
ASP A 316
GLN A 166
 GOL  A1542 ( 4.4A)
GOL  A1542 ( 3.6A)
None
GOL  A1548 (-3.5A)
GOL  A1542 ( 3.5A)
 0.89A 3aicF-4aieA:
3.5		 3aicF-4aieA:
20.25
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.
3AIC_G_ACRG5044_1
(GLUCOSYLTRANSFERASE-
SI)		 4aie GLUCAN
1,6-ALPHA-GLUCOSIDAS
E
(Lactobacillus
acidophilus) 		6 / 12 ARG A 196
ASP A 198
GLU A 240
HIS A 315
ASP A 316
ASP A  59
 GOL  A1542 ( 4.4A)
GOL  A1542 (-2.7A)
GOL  A1542 ( 3.6A)
None
GOL  A1548 (-3.5A)
GOL  A1542 (-2.1A)
 0.69A 3aicG-4aieA:
3.4		 3aicG-4aieA:
20.25
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.
3AIC_G_ACRG5044_1
(GLUCOSYLTRANSFERASE-
SI)		 4aie GLUCAN
1,6-ALPHA-GLUCOSIDAS
E
(Lactobacillus
acidophilus) 		6 / 12 ARG A 196
ASP A 198
GLU A 240
HIS A 315
ASP A 316
GLN A 166
 GOL  A1542 ( 4.4A)
GOL  A1542 (-2.7A)
GOL  A1542 ( 3.6A)
None
GOL  A1548 (-3.5A)
GOL  A1542 ( 3.5A)
 0.90A 3aicG-4aieA:
3.4		 3aicG-4aieA:
20.25
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.
3AIC_H_ACRH5044_1
(GLUCOSYLTRANSFERASE-
SI)		 4aie GLUCAN
1,6-ALPHA-GLUCOSIDAS
E
(Lactobacillus
acidophilus) 		6 / 12 ARG A 196
ASP A 198
GLU A 240
HIS A 315
ASP A 316
ASP A  59
 GOL  A1542 ( 4.4A)
GOL  A1542 (-2.7A)
GOL  A1542 ( 3.6A)
None
GOL  A1548 (-3.5A)
GOL  A1542 (-2.1A)
 0.72A 3aicH-4aieA:
5.9		 3aicH-4aieA:
20.25
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.
3CZV_A_AZMA263_1
(CARBONIC ANHYDRASE
13)		 4aie GLUCAN
1,6-ALPHA-GLUCOSIDAS
E
(Lactobacillus
acidophilus) 		5 / 12 VAL A 522
PHE A 503
LEU A 491
VAL A 537
VAL A 471
 None
 1.20A 3czvA-4aieA:
undetectable
3czvB-4aieA:
undetectable		 3czvA-4aieA:
21.28
3czvB-4aieA:
21.28
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.
3KO0_I_TFPI202_1
(PROTEIN S100-A4)		 4aie GLUCAN
1,6-ALPHA-GLUCOSIDAS
E
(Lactobacillus
acidophilus) 		5 / 12 ASP A 316
PHE A 352
PHE A  18
LEU A  49
ASP A  97
 GOL  A1548 (-3.5A)
None
None
None
None
 1.21A 3ko0G-4aieA:
undetectable
3ko0H-4aieA:
undetectable
3ko0I-4aieA:
undetectable
3ko0J-4aieA:
undetectable		 3ko0G-4aieA:
11.87
3ko0H-4aieA:
11.87
3ko0I-4aieA:
11.87
3ko0J-4aieA:
11.87
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.
3KO0_J_TFPJ202_1
(PROTEIN S100-A4)		 4aie GLUCAN
1,6-ALPHA-GLUCOSIDAS
E
(Lactobacillus
acidophilus) 		5 / 11 ASP A 316
PHE A 352
LEU A  49
ASP A  97
PHE A  18
 GOL  A1548 (-3.5A)
None
None
None
None
 1.26A 3ko0A-4aieA:
undetectable
3ko0B-4aieA:
undetectable
3ko0I-4aieA:
undetectable
3ko0J-4aieA:
undetectable		 3ko0A-4aieA:
11.87
3ko0B-4aieA:
11.87
3ko0I-4aieA:
11.87
3ko0J-4aieA:
11.87
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.
3KO0_L_TFPL202_1
(PROTEIN S100-A4)		 4aie GLUCAN
1,6-ALPHA-GLUCOSIDAS
E
(Lactobacillus
acidophilus) 		5 / 12 LEU A  49
ASP A  97
PHE A  18
ASP A 316
PHE A 352
 None
None
None
GOL  A1548 (-3.5A)
None
 1.14A 3ko0K-4aieA:
undetectable
3ko0L-4aieA:
undetectable
3ko0M-4aieA:
undetectable
3ko0N-4aieA:
undetectable		 3ko0K-4aieA:
11.87
3ko0L-4aieA:
11.87
3ko0M-4aieA:
11.87
3ko0N-4aieA:
11.87
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.
3M0W_A_P77A203_1
(PROTEIN S100-A4)		 4aie GLUCAN
1,6-ALPHA-GLUCOSIDAS
E
(Lactobacillus
acidophilus) 		5 / 10 ASP A 316
PHE A 352
LEU A  49
ASP A  97
PHE A  18
 GOL  A1548 (-3.5A)
None
None
None
None
 1.23A 3m0wA-4aieA:
undetectable
3m0wB-4aieA:
undetectable
3m0wI-4aieA:
undetectable
3m0wJ-4aieA:
undetectable		 3m0wA-4aieA:
11.71
3m0wB-4aieA:
11.71
3m0wI-4aieA:
11.71
3m0wJ-4aieA:
11.71
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.
3M0W_C_P77C203_1
(PROTEIN S100-A4)		 4aie GLUCAN
1,6-ALPHA-GLUCOSIDAS
E
(Lactobacillus
acidophilus) 		5 / 10 ASP A 316
PHE A 352
PHE A  18
LEU A  49
ASP A  97
 GOL  A1548 (-3.5A)
None
None
None
None
 1.11A 3m0wC-4aieA:
undetectable
3m0wD-4aieA:
undetectable
3m0wE-4aieA:
undetectable
3m0wF-4aieA:
undetectable		 3m0wC-4aieA:
11.71
3m0wD-4aieA:
11.71
3m0wE-4aieA:
11.71
3m0wF-4aieA:
11.71
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.
3M0W_D_P77D203_1
(PROTEIN S100-A4)		 4aie GLUCAN
1,6-ALPHA-GLUCOSIDAS
E
(Lactobacillus
acidophilus) 		5 / 10 PHE A  18
LEU A  49
ASP A  97
PHE A 352
ASP A 316
 None
None
None
None
GOL  A1548 (-3.5A)
 1.18A 3m0wA-4aieA:
undetectable
3m0wB-4aieA:
undetectable
3m0wC-4aieA:
undetectable
3m0wD-4aieA:
undetectable		 3m0wA-4aieA:
11.71
3m0wB-4aieA:
11.71
3m0wC-4aieA:
11.71
3m0wD-4aieA:
11.71
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.
3M0W_H_P77H203_1
(PROTEIN S100-A4)		 4aie GLUCAN
1,6-ALPHA-GLUCOSIDAS
E
(Lactobacillus
acidophilus) 		5 / 10 LEU A  49
ASP A  97
PHE A  18
PHE A 352
ASP A 316
 None
None
None
None
GOL  A1548 (-3.5A)
 1.23A 3m0wE-4aieA:
undetectable
3m0wF-4aieA:
undetectable
3m0wG-4aieA:
undetectable
3m0wH-4aieA:
undetectable		 3m0wE-4aieA:
11.71
3m0wF-4aieA:
11.71
3m0wG-4aieA:
11.71
3m0wH-4aieA:
11.71
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.
3R24_A_SAMA302_0
(2'-O-METHYL
TRANSFERASE)		 4aie GLUCAN
1,6-ALPHA-GLUCOSIDAS
E
(Lactobacillus
acidophilus) 		5 / 12 GLY A 325
SER A 497
PRO A 529
LEU A 285
ASP A 272
 None
None
MES  A1539 (-4.1A)
None
None
 1.36A 3r24A-4aieA:
undetectable		 3r24A-4aieA:
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.
3SG8_A_TOYA305_1
(APH(2'')-ID)		 4aie GLUCAN
1,6-ALPHA-GLUCOSIDAS
E
(Lactobacillus
acidophilus) 		5 / 12 ASN A  60
SER A 375
ASP A 316
TYR A  14
TRP A 424
 None
None
GOL  A1548 (-3.5A)
None
None
 1.34A 3sg8A-4aieA:
1.5		 3sg8A-4aieA:
20.18
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.
3T3Z_C_9PLC501_1
(CYTOCHROME P450 2E1)		 4aie GLUCAN
1,6-ALPHA-GLUCOSIDAS
E
(Lactobacillus
acidophilus) 		4 / 5 PHE A 533
ALA A 480
THR A 474
LEU A 527
 None
 1.07A 3t3zC-4aieA:
undetectable		 3t3zC-4aieA:
22.16
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.
3V5W_A_8PRA701_2
(G-PROTEIN COUPLED
RECEPTOR KINASE 2)		 4aie GLUCAN
1,6-ALPHA-GLUCOSIDAS
E
(Lactobacillus
acidophilus) 		3 / 3 LEU A  83
MET A  77
ASP A  71
 None
 0.66A 3v5wA-4aieA:
undetectable		 3v5wA-4aieA:
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.
4E1G_A_LNLA701_2
(PROSTAGLANDIN G/H
SYNTHASE 2)		 4aie GLUCAN
1,6-ALPHA-GLUCOSIDAS
E
(Lactobacillus
acidophilus) 		4 / 5 VAL A 471
LEU A 470
SER A 469
MET A 345
 None
 1.10A 4e1gA-4aieA:
undetectable		 4e1gA-4aieA:
20.43
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.
4K0B_B_SAMB504_1
(S-ADENOSYLMETHIONINE
SYNTHASE)		 4aie GLUCAN
1,6-ALPHA-GLUCOSIDAS
E
(Lactobacillus
acidophilus) 		4 / 8 PRO A  56
ASP A  63
ALA A 163
SER A 104
 None
 0.99A 4k0bB-4aieA:
undetectable		 4k0bB-4aieA:
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.
4L7I_B_SAMB501_1
(S-ADENOSYLMETHIONINE
SYNTHASE)		 4aie GLUCAN
1,6-ALPHA-GLUCOSIDAS
E
(Lactobacillus
acidophilus) 		4 / 8 PRO A  56
ASP A  63
ALA A 163
SER A 104
 None
 1.00A 4l7iB-4aieA:
undetectable		 4l7iB-4aieA:
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.
4Z3O_F_MFXF101_1
(DNA TOPOISOMERASE 4
SUBUNIT
B,PARE30-PARC55
FUSED TOPO IV FROM
S. PNEUMONIAE
E-SITE DNA)		 4aie GLUCAN
1,6-ALPHA-GLUCOSIDAS
E
(Lactobacillus
acidophilus) 		4 / 5 ARG A 319
ARG A 401
GLY A 400
GLU A 374
 None
GOL  A1542 ( 3.1A)
None
GOL  A1548 (-3.0A)
 1.24A 4z3oA-4aieA:
undetectable
4z3oB-4aieA:
undetectable		 4z3oA-4aieA:
21.72
4z3oB-4aieA:
21.72
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.
5CSY_B_ACRB601_1
(4-ALPHA-GLUCANOTRANS
FERASE DPE1,
CHLOROPLASTIC/AMYLOP
LASTIC)		 4aie GLUCAN
1,6-ALPHA-GLUCOSIDAS
E
(Lactobacillus
acidophilus) 		5 / 12 ARG A 196
ASP A 198
GLU A 240
HIS A 315
ASP A 316
 GOL  A1542 ( 4.4A)
GOL  A1542 (-2.7A)
GOL  A1542 ( 3.6A)
None
GOL  A1548 (-3.5A)
 0.35A 5csyB-4aieA:
4.1		 5csyB-4aieA:
22.27
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.
5JWA_A_ACTA612_0
(NADH DEHYDROGENASE,
PUTATIVE)		 4aie GLUCAN
1,6-ALPHA-GLUCOSIDAS
E
(Lactobacillus
acidophilus) 		3 / 3 LYS A 117
ASP A 118
ARG A 153
 GOL  A1546 (-2.4A)
None
None
 0.80A 5jwaA-4aieA:
undetectable
5jwaH-4aieA:
undetectable		 5jwaA-4aieA:
22.59
5jwaH-4aieA:
22.59
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.
5LJE_A_RTLA201_1
(RETINOL-BINDING
PROTEIN 1)		 4aie GLUCAN
1,6-ALPHA-GLUCOSIDAS
E
(Lactobacillus
acidophilus) 		4 / 6 LEU A  36
ILE A  70
MET A  77
MET A  96
 None
 1.37A 5ljeA-4aieA:
undetectable		 5ljeA-4aieA:
14.29
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.
5O4Y_F_CCSF14_0
(PHE-MAA-ASN-PRO-HIS-
LEU-SER-TRP-SER-TRP-
9KK-9KK-ARG-CCS-GLY-
NH2)		 4aie GLUCAN
1,6-ALPHA-GLUCOSIDAS
E
(Lactobacillus
acidophilus) 		4 / 6 LEU A  29
SER A  34
ARG A  35
GLY A  31
 None
None
MES  A1547 (-3.9A)
None
 1.13A 5o4yF-4aieA:
undetectable		 5o4yF-4aieA:
2.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5UMD_A_YMZA3801_1
(60S RIBOSOMAL
PROTEIN L28
28S RIBOSOMAL RNA
60S RIBOSOMAL
PROTEIN L4)		 4aie GLUCAN
1,6-ALPHA-GLUCOSIDAS
E
(Lactobacillus
acidophilus) 		4 / 6 ASN A  60
PRO A  15
ASP A  59
TYR A  62
 None
None
GOL  A1542 (-2.1A)
GOL  A1542 (-3.6A)
 1.16A 5umd2-4aieA:
undetectable
5umdF-4aieA:
undetectable		 5umd2-4aieA:
9.65
5umdF-4aieA:
9.44
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.
6AG0_A_ACRA610_0
(ALPHA-AMYLASE)		 4aie GLUCAN
1,6-ALPHA-GLUCOSIDAS
E
(Lactobacillus
acidophilus) 		5 / 12 TYR A  62
HIS A 102
ASP A 198
HIS A 315
ASP A 316
 GOL  A1542 (-3.6A)
GOL  A1542 (-3.0A)
GOL  A1542 (-2.7A)
None
GOL  A1548 (-3.5A)
 0.44A 6ag0A-4aieA:
21.2		 6ag0A-4aieA:
9.28