SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '2e3j'

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.
1BX4_A_ADNA355_1
(PROTEIN (ADENOSINE
KINASE))		 2e3j EPOXIDE HYDROLASE
EPHB
(Mycobacterium
tuberculosis) 		5 / 12 GLY A 138
VAL A 129
GLN A 165
ILE A 275
GLY A 133
 None
None
None
ACT  A2004 ( 4.2A)
None
 0.81A 1bx4A-2e3jA:
undetectable		 1bx4A-2e3jA:
21.62
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.
1GYX_A_BEZA1077_0
(HYPOTHETICAL PROTEIN
YDCE)		 2e3j EPOXIDE HYDROLASE
EPHB
(Mycobacterium
tuberculosis) 		4 / 7 ARG A 314
TYR A 152
PRO A 143
SER A 142
 None
 1.47A 1gyxA-2e3jA:
0.3
1gyxB-2e3jA:
0.2		 1gyxA-2e3jA:
11.52
1gyxB-2e3jA:
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.
1NBI_C_SAMC2293_0
(GLYCINE
N-METHYLTRANSFERASE)		 2e3j EPOXIDE HYDROLASE
EPHB
(Mycobacterium
tuberculosis) 		5 / 12 GLY A 332
ALA A 339
GLY A 304
SER A 128
HIS A 103
 None
 1.31A 1nbiC-2e3jA:
undetectable		 1nbiC-2e3jA:
22.07
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.
1NRM_A_DVAA6_0
(GRAMICIDIN A)		 2e3j EPOXIDE HYDROLASE
EPHB
(Mycobacterium
tuberculosis) 		3 / 3 ALA A 107
VAL A 101
TRP A  43
 None
 0.92A 1nrmA-2e3jA:
undetectable		 1nrmA-2e3jA:
3.93
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.
1NRM_B_DVAB6_0
(GRAMICIDIN A)		 2e3j EPOXIDE HYDROLASE
EPHB
(Mycobacterium
tuberculosis) 		3 / 3 ALA A 107
VAL A 101
TRP A  43
 None
 0.92A 1nrmB-2e3jA:
undetectable		 1nrmB-2e3jA:
3.93
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.
1NT5_A_DVAA6_0
(GRAMICIDIN A)		 2e3j EPOXIDE HYDROLASE
EPHB
(Mycobacterium
tuberculosis) 		3 / 3 ALA A 107
VAL A 101
TRP A  43
 None
 0.89A 1nt5A-2e3jA:
undetectable		 1nt5A-2e3jA:
3.65
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.
1NT5_B_DVAB6_0
(GRAMICIDIN A)		 2e3j EPOXIDE HYDROLASE
EPHB
(Mycobacterium
tuberculosis) 		3 / 3 ALA A 107
VAL A 101
TRP A  43
 None
 0.89A 1nt5B-2e3jA:
undetectable		 1nt5B-2e3jA:
3.65
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.
2A1M_B_CAMB2422_0
(CYTOCHROME P450-CAM)		 2e3j EPOXIDE HYDROLASE
EPHB
(Mycobacterium
tuberculosis) 		4 / 8 TYR A 164
VAL A 303
GLY A 304
ILE A 221
 ACT  A2005 (-4.6A)
None
None
None
 0.82A 2a1mB-2e3jA:
undetectable		 2a1mB-2e3jA:
20.81
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.
2A3C_B_PNXB2434_1
(CHITINASE)		 2e3j EPOXIDE HYDROLASE
EPHB
(Mycobacterium
tuberculosis) 		4 / 6 TRP A 115
GLY A 145
PHE A 144
SER A 142
 None
 1.37A 2a3cB-2e3jA:
undetectable		 2a3cB-2e3jA:
21.92
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.
2AOI_C_FRDC305_1
(POL POLYPROTEIN
PEPTIDE INHIBITOR)		 2e3j EPOXIDE HYDROLASE
EPHB
(Mycobacterium
tuberculosis) 		4 / 5 GLY A 308
PRO A 217
VAL A 220
ILE A 221
 None
 0.84A 2aoiA-2e3jA:
undetectable		 2aoiA-2e3jA:
13.45
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.
2HA4_B_ACHB603_0
(ACETYLCHOLINESTERASE)		 2e3j EPOXIDE HYDROLASE
EPHB
(Mycobacterium
tuberculosis) 		4 / 7 TRP A 307
TYR A 152
TYR A 164
GLY A 304
 None
None
ACT  A2005 (-4.6A)
None
 1.26A 2ha4B-2e3jA:
12.6		 2ha4B-2e3jA:
23.37
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.
3ADS_A_IMNA1_1
(PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA)		 2e3j EPOXIDE HYDROLASE
EPHB
(Mycobacterium
tuberculosis) 		5 / 10 GLU A 338
ILE A 328
GLY A 299
LEU A 295
ILE A 127
 None
 1.24A 3adsA-2e3jA:
undetectable		 3adsA-2e3jA:
21.20
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.
3DMF_A_SAMA388_0
(PROBABLE RIBOSOMAL
RNA SMALL SUBUNIT
METHYLTRANSFERASE)		 2e3j EPOXIDE HYDROLASE
EPHB
(Mycobacterium
tuberculosis) 		5 / 12 TYR A  65
GLY A 102
GLY A 126
ALA A 294
ASP A 104
 None
None
None
None
ACT  A2005 ( 4.0A)
 1.00A 3dmfA-2e3jA:
undetectable		 3dmfA-2e3jA:
22.93
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.
3DMH_A_SAMA384_0
(PROBABLE RIBOSOMAL
RNA SMALL SUBUNIT
METHYLTRANSFERASE)		 2e3j EPOXIDE HYDROLASE
EPHB
(Mycobacterium
tuberculosis) 		5 / 12 TYR A  65
GLY A 102
GLY A 126
ALA A 294
ASP A 104
 None
None
None
None
ACT  A2005 ( 4.0A)
 0.99A 3dmhA-2e3jA:
2.2		 3dmhA-2e3jA:
22.93
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.
3FO7_A_IMNA301_1
(PHOSPHOLIPASE A2
VRV-PL-VIIIA)		 2e3j EPOXIDE HYDROLASE
EPHB
(Mycobacterium
tuberculosis) 		4 / 5 HIS A  34
ASP A  61
TYR A  65
PRO A 268
 None
 1.20A 3fo7A-2e3jA:
undetectable		 3fo7A-2e3jA:
15.13
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.
3G1U_B_ADNB438_2
(ADENOSYLHOMOCYSTEINA
SE)		 2e3j EPOXIDE HYDROLASE
EPHB
(Mycobacterium
tuberculosis) 		3 / 3 THR A 190
GLU A 338
HIS A  45
 ACT  A2003 (-3.3A)
None
None
 0.78A 3g1uB-2e3jA:
5.3		 3g1uB-2e3jA:
20.00
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.
3H1X_A_IMNA301_1
(PHOSPHOLIPASE A2
VRV-PL-VIIIA)		 2e3j EPOXIDE HYDROLASE
EPHB
(Mycobacterium
tuberculosis) 		4 / 5 HIS A  34
ASP A  61
TYR A  65
PRO A 268
 None
 1.16A 3h1xA-2e3jA:
undetectable		 3h1xA-2e3jA:
15.13
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.
3SO9_A_017A100_1
(HIV-1 PROTEASE)		 2e3j EPOXIDE HYDROLASE
EPHB
(Mycobacterium
tuberculosis) 		4 / 8 GLY A 304
GLY A 126
ILE A 127
THR A 325
 None
 0.62A 3so9A-2e3jA:
undetectable		 3so9A-2e3jA:
13.95
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.
3VQR_A_ACTA1002_0
(PUTATIVE
OXIDOREDUCTASE)		 2e3j EPOXIDE HYDROLASE
EPHB
(Mycobacterium
tuberculosis) 		4 / 6 GLY A 304
VAL A 303
TRP A 307
ASP A 302
 None
 1.10A 3vqrA-2e3jA:
undetectable		 3vqrA-2e3jA:
22.10
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.
4B17_A_SAMA1358_0
(RIBOSOMAL RNA LARGE
SUBUNIT
METHYLTRANSFERASE M)		 2e3j EPOXIDE HYDROLASE
EPHB
(Mycobacterium
tuberculosis) 		5 / 12 GLY A  88
GLY A  12
ASP A  91
ASP A  85
VAL A  83
 None
 0.98A 4b17A-2e3jA:
undetectable		 4b17A-2e3jA:
23.54
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.
4IIL_A_RBFA401_2
(MEMBRANE LIPOPROTEIN
TPN38(B))		 2e3j EPOXIDE HYDROLASE
EPHB
(Mycobacterium
tuberculosis) 		4 / 8 PRO A 217
VAL A 220
PRO A 225
ILE A 306
 None
 1.10A 4iilA-2e3jA:
3.3		 4iilA-2e3jA:
24.45
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.
4J03_A_FVSA603_1
(BIFUNCTIONAL EPOXIDE
HYDROLASE 2)		 2e3j EPOXIDE HYDROLASE
EPHB
(Mycobacterium
tuberculosis) 		6 / 12 ASP A 104
TYR A 164
LEU A 189
LEU A 234
TYR A 272
HIS A 333
 ACT  A2005 ( 4.0A)
ACT  A2005 (-4.6A)
None
None
None
ACT  A2005 (-4.3A)
 0.73A 4j03A-2e3jA:
39.0		 4j03A-2e3jA:
23.92
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.
4J03_A_FVSA603_1
(BIFUNCTIONAL EPOXIDE
HYDROLASE 2)		 2e3j EPOXIDE HYDROLASE
EPHB
(Mycobacterium
tuberculosis) 		6 / 12 ASP A 104
TYR A 164
LEU A 189
TYR A 272
HIS A 333
TRP A 334
 ACT  A2005 ( 4.0A)
ACT  A2005 (-4.6A)
None
None
ACT  A2005 (-4.3A)
ACT  A2003 (-4.1A)
 0.81A 4j03A-2e3jA:
39.0		 4j03A-2e3jA:
23.92
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.
4J03_A_FVSA603_1
(BIFUNCTIONAL EPOXIDE
HYDROLASE 2)		 2e3j EPOXIDE HYDROLASE
EPHB
(Mycobacterium
tuberculosis) 		6 / 12 ASP A 104
TYR A 164
PHE A 168
LEU A 234
TYR A 272
HIS A 333
 ACT  A2005 ( 4.0A)
ACT  A2005 (-4.6A)
None
None
None
ACT  A2005 (-4.3A)
 0.72A 4j03A-2e3jA:
39.0		 4j03A-2e3jA:
23.92
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.
4J03_A_FVSA603_1
(BIFUNCTIONAL EPOXIDE
HYDROLASE 2)		 2e3j EPOXIDE HYDROLASE
EPHB
(Mycobacterium
tuberculosis) 		6 / 12 ASP A 104
TYR A 164
PHE A 168
TYR A 272
HIS A 333
TRP A 334
 ACT  A2005 ( 4.0A)
ACT  A2005 (-4.6A)
None
None
ACT  A2005 (-4.3A)
ACT  A2003 (-4.1A)
 0.48A 4j03A-2e3jA:
39.0		 4j03A-2e3jA:
23.92
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.
4MMF_B_29QB603_1
(TRANSPORTER)		 2e3j EPOXIDE HYDROLASE
EPHB
(Mycobacterium
tuberculosis) 		5 / 9 ASP A  20
VAL A  30
GLY A  52
SER A  21
GLY A  27
 None
None
None
None
ACT  A2006 ( 4.8A)
 1.40A 4mmfB-2e3jA:
undetectable		 4mmfB-2e3jA:
23.74
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.
4RZV_A_032A801_2
(SERINE/THREONINE-PRO
TEIN KINASE B-RAF)		 2e3j EPOXIDE HYDROLASE
EPHB
(Mycobacterium
tuberculosis) 		4 / 5 ILE A  47
VAL A  57
PHE A 113
HIS A  45
 None
 0.98A 4rzvA-2e3jA:
undetectable		 4rzvA-2e3jA:
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.
4W5N_A_IPHA901_0
(PROTEIN ARGONAUTE-2)		 2e3j EPOXIDE HYDROLASE
EPHB
(Mycobacterium
tuberculosis) 		3 / 3 VAL A 124
ALA A 122
PHE A 350
 None
 0.94A 4w5nA-2e3jA:
undetectable		 4w5nA-2e3jA:
16.61
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.
5EF8_B_LBHB2004_1
(HDAC6 PROTEIN)		 2e3j EPOXIDE HYDROLASE
EPHB
(Mycobacterium
tuberculosis) 		5 / 12 ASP A 104
PRO A  37
SER A  39
PHE A 255
LEU A 186
 ACT  A2005 ( 4.0A)
ACT  A2003 ( 4.5A)
None
None
ACT  A2003 ( 4.2A)
 1.46A 5ef8B-2e3jA:
undetectable		 5ef8B-2e3jA:
20.75
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.
5KB6_B_ADNB401_1
(ADENOSINE KINASE)		 2e3j EPOXIDE HYDROLASE
EPHB
(Mycobacterium
tuberculosis) 		5 / 12 GLY A 138
VAL A 129
GLN A 165
ILE A 275
GLY A 133
 None
None
None
ACT  A2004 ( 4.2A)
None
 0.92A 5kb6B-2e3jA:
3.8		 5kb6B-2e3jA:
21.36
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.
6AF6_A_GLYA507_0
(L-PROLYL-[PEPTIDYL-C
ARRIER PROTEIN]
DEHYDROGENASE)		 2e3j EPOXIDE HYDROLASE
EPHB
(Mycobacterium
tuberculosis) 		3 / 3 TYR A 322
HIS A 326
MET A 327
 None
 0.97A 6af6A-2e3jA:
undetectable		 6af6A-2e3jA:
22.86