SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4a29'

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.
1MT1_G_AG2G7003_1
(PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE BETA
CHAIN
PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE ALPHA
CHAIN)		 4a29 ENGINEERED
RETRO-ALDOL ENZYME
RA95.0
(synthetic
construct) 		4 / 6 LEU A  33
ASP A 128
GLY A 126
ARG A  28
 None
 0.60A 1mt1G-4a29A:
undetectable
1mt1J-4a29A:
undetectable		 1mt1G-4a29A:
15.02
1mt1J-4a29A:
19.51
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.
1MT1_K_AG2K7002_1
(PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE ALPHA
CHAIN
PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE BETA
CHAIN)		 4a29 ENGINEERED
RETRO-ALDOL ENZYME
RA95.0
(synthetic
construct) 		4 / 7 ARG A  28
LEU A  33
ASP A 128
GLY A 126
 None
 0.60A 1mt1H-4a29A:
undetectable
1mt1K-4a29A:
undetectable		 1mt1H-4a29A:
19.51
1mt1K-4a29A:
15.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1N13_D_AG2D7015_1
(PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE ALPHA
CHAIN
PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE BETA
CHAIN)		 4a29 ENGINEERED
RETRO-ALDOL ENZYME
RA95.0
(synthetic
construct) 		4 / 7 ARG A  28
LEU A  33
ASP A 128
GLY A 126
 None
 0.59A 1n13D-4a29A:
undetectable
1n13E-4a29A:
undetectable		 1n13D-4a29A:
19.51
1n13E-4a29A:
15.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1N13_F_AG2F7016_1
(PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE BETA
CHAIN
PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE ALPHA
CHAIN)		 4a29 ENGINEERED
RETRO-ALDOL ENZYME
RA95.0
(synthetic
construct) 		4 / 8 LEU A  33
ASP A 128
GLY A 126
ARG A  28
 None
 0.58A 1n13A-4a29A:
undetectable
1n13F-4a29A:
undetectable		 1n13A-4a29A:
15.02
1n13F-4a29A:
19.51
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.
1N13_H_AG2H7012_1
(PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE ALPHA
CHAIN
PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE BETA
CHAIN)		 4a29 ENGINEERED
RETRO-ALDOL ENZYME
RA95.0
(synthetic
construct) 		4 / 6 ARG A  28
LEU A  33
ASP A 128
GLY A 126
 None
 0.60A 1n13H-4a29A:
undetectable
1n13K-4a29A:
undetectable		 1n13H-4a29A:
19.51
1n13K-4a29A:
15.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1N13_J_AG2J7013_1
(PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE BETA
CHAIN
PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE ALPHA
CHAIN)		 4a29 ENGINEERED
RETRO-ALDOL ENZYME
RA95.0
(synthetic
construct) 		4 / 7 LEU A  33
ASP A 128
GLY A 126
ARG A  28
 None
 0.60A 1n13G-4a29A:
undetectable
1n13J-4a29A:
undetectable		 1n13G-4a29A:
15.02
1n13J-4a29A:
19.51
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.
2NNH_B_9CRB501_1
(CYTOCHROME P450 2C8)		 4a29 ENGINEERED
RETRO-ALDOL ENZYME
RA95.0
(synthetic
construct) 		5 / 9 GLY A 153
SER A 151
THR A  84
VAL A 130
ILE A 113
 None
 1.33A 2nnhB-4a29A:
undetectable		 2nnhB-4a29A:
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.
2QQC_E_AG2E671_1
(PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE (EC
4.1.1.19) (PVLARGDC))		 4a29 ENGINEERED
RETRO-ALDOL ENZYME
RA95.0
(synthetic
construct) 		4 / 7 ARG A  28
LEU A  33
ASP A 128
GLY A 126
 None
 0.58A 2qqcD-4a29A:
undetectable
2qqcE-4a29A:
undetectable		 2qqcD-4a29A:
19.67
2qqcE-4a29A:
14.59
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.
2QQC_K_AG2K671_1
(PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE (EC
4.1.1.19) (PVLARGDC))		 4a29 ENGINEERED
RETRO-ALDOL ENZYME
RA95.0
(synthetic
construct) 		4 / 8 ARG A  28
LEU A  33
ASP A 128
GLY A 126
 None
 0.61A 2qqcH-4a29A:
undetectable
2qqcK-4a29A:
undetectable		 2qqcH-4a29A:
19.67
2qqcK-4a29A:
14.59
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.
2QQD_B_AG2B671_1
(PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE (EC
4.1.1.19) (PVLARGDC))		 4a29 ENGINEERED
RETRO-ALDOL ENZYME
RA95.0
(synthetic
construct) 		4 / 8 ARG A  28
LEU A  33
ASP A 128
GLY A 126
 None
 0.60A 2qqdB-4a29A:
undetectable
2qqdC-4a29A:
undetectable		 2qqdB-4a29A:
19.51
2qqdC-4a29A:
18.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ZGW_A_ADNA1301_1
(BIOTIN--[ACETYL-COA-
CARBOXYLASE] LIGASE)		 4a29 ENGINEERED
RETRO-ALDOL ENZYME
RA95.0
(synthetic
construct) 		4 / 7 GLU A  39
ALA A 229
ASN A  41
ALA A  47
 None
 0.94A 2zgwA-4a29A:
undetectable		 2zgwA-4a29A:
25.35
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.
2ZGW_B_ADNB1302_1
(BIOTIN--[ACETYL-COA-
CARBOXYLASE] LIGASE)		 4a29 ENGINEERED
RETRO-ALDOL ENZYME
RA95.0
(synthetic
construct) 		4 / 6 GLU A  39
ALA A 229
ASN A  41
ALA A  47
 None
 0.92A 2zgwB-4a29A:
undetectable		 2zgwB-4a29A:
25.35
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.
3AF0_A_PAUA314_0
(PANTOTHENATE KINASE)		 4a29 ENGINEERED
RETRO-ALDOL ENZYME
RA95.0
(synthetic
construct) 		4 / 8 VAL A 103
ASP A 128
LEU A  33
GLY A  79
 None
 0.98A 3af0A-4a29A:
undetectable		 3af0A-4a29A:
22.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3B9L_A_AZZA1010_1
(SERUM ALBUMIN)		 4a29 ENGINEERED
RETRO-ALDOL ENZYME
RA95.0
(synthetic
construct) 		4 / 8 LEU A 145
ILE A 119
ARG A 150
GLY A 153
 None
 0.93A 3b9lA-4a29A:
undetectable		 3b9lA-4a29A:
17.83
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.
3E9X_A_NIMA1_1
(LACTOTRANSFERRIN')		 4a29 ENGINEERED
RETRO-ALDOL ENZYME
RA95.0
(synthetic
construct) 		4 / 4 GLU A  53
GLY A  91
THR A  84
GLU A  86
 MLT  A 300 (-3.0A)
None
None
None
 0.99A 3e9xA-4a29A:
undetectable		 3e9xA-4a29A:
22.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3HCN_A_CHDA3_0
(FERROCHELATASE,
MITOCHONDRIAL)		 4a29 ENGINEERED
RETRO-ALDOL ENZYME
RA95.0
(synthetic
construct) 		4 / 7 LEU A 159
ARG A 182
SER A  81
GLY A 212
 None
MLT  A 300 ( 3.9A)
None
MLT  A 300 (-2.8A)
 1.09A 3hcnA-4a29A:
undetectable		 3hcnA-4a29A:
22.99
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.
4B3A_A_TACA222_1
(TETRACYCLINE
REPRESSOR PROTEIN
CLASS D)		 4a29 ENGINEERED
RETRO-ALDOL ENZYME
RA95.0
(synthetic
construct) 		5 / 12 LEU A 231
SER A 181
ARG A 223
GLN A 194
ILE A 198
 None
MLT  A 300 ( 4.4A)
None
None
None
 1.42A 4b3aA-4a29A:
undetectable		 4b3aA-4a29A:
20.97
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.
4F4D_A_CHDA504_0
(FERROCHELATASE,
MITOCHONDRIAL)		 4a29 ENGINEERED
RETRO-ALDOL ENZYME
RA95.0
(synthetic
construct) 		5 / 12 LEU A 157
LEU A 108
ILE A 179
GLN A 194
THR A  83
 None
None
None
None
3NK  A 299 ( 4.5A)
 1.26A 4f4dA-4a29A:
undetectable		 4f4dA-4a29A:
22.99
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4OU1_A_BEZA302_0
(RETRO-ALDOLASE,
DESIGN RA114)		 4a29 ENGINEERED
RETRO-ALDOL ENZYME
RA95.0
(synthetic
construct) 		4 / 8 ILE A 133
LYS A 135
ASN A 161
LYS A 210
 None
None
None
3NK  A 299 (-1.3A)
 0.86A 4ou1A-4a29A:
43.3		 4ou1A-4a29A:
94.96
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.
5VKQ_B_PCFB1802_0
(NO MECHANORECEPTOR
POTENTIAL C ISOFORM
L)		 4a29 ENGINEERED
RETRO-ALDOL ENZYME
RA95.0
(synthetic
construct) 		4 / 7 SER A  81
THR A  83
PHE A  89
ILE A 113
 None
3NK  A 299 ( 4.5A)
3NK  A 299 (-4.2A)
None
 1.23A 5vkqA-4a29A:
undetectable
5vkqB-4a29A:
undetectable		 5vkqA-4a29A:
9.70
5vkqB-4a29A:
9.70
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.
5VKQ_D_PCFD1803_0
(NO MECHANORECEPTOR
POTENTIAL C ISOFORM
L)		 4a29 ENGINEERED
RETRO-ALDOL ENZYME
RA95.0
(synthetic
construct) 		4 / 7 SER A  81
THR A  83
PHE A  89
ILE A 113
 None
3NK  A 299 ( 4.5A)
3NK  A 299 (-4.2A)
None
 1.22A 5vkqC-4a29A:
undetectable
5vkqD-4a29A:
undetectable		 5vkqC-4a29A:
9.70
5vkqD-4a29A:
9.70
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.
6BTX_A_EDTA503_0
(SOLUTE CARRIER
FAMILY 39
(IRON-REGULATED
TRANSPORTER))		 4a29 ENGINEERED
RETRO-ALDOL ENZYME
RA95.0
(synthetic
construct) 		4 / 7 SER A  56
SER A 234
GLY A 212
ARG A 238
 MLT  A 300 (-3.8A)
MLT  A 300 (-3.0A)
MLT  A 300 (-2.8A)
None
 1.15A 6btxA-4a29A:
undetectable		 6btxA-4a29A:
21.29