SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '5ej2'

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.
1FDU_D_ESTD352_1
(17-BETA-HYDROXYSTERO
ID DEHYDROGENASE)		 5ej2 CARVEOL
DEHYDROGENASE
(Mycobacterium
avium) 		4 / 6 SER A 165
VAL A 166
GLY A 167
TYR A 178
 NAD  A 300 (-3.5A)
None
None
NAD  A 300 (-4.8A)
 0.65A 1fduD-5ej2A:
26.5		 1fduD-5ej2A:
24.93
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.
1KGL_A_RTLA175_1
(CELLULAR
RETINOL-BINDING
PROTEIN TYPE I)		 5ej2 CARVEOL
DEHYDROGENASE
(Mycobacterium
avium) 		4 / 7 LEU A 207
ILE A 135
MET A 132
MET A 215
 None
NAD  A 300 (-3.8A)
None
NAD  A 300 (-3.6A)
 1.14A 1kglA-5ej2A:
undetectable		 1kglA-5ej2A:
17.23
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.
1U1J_A_C2FA773_0
(5-METHYLTETRAHYDROPT
EROYLTRIGLUTAMATE--H
OMOCYSTEINE
METHYLTRANSFERASE)		 5ej2 CARVEOL
DEHYDROGENASE
(Mycobacterium
avium) 		4 / 8 ARG A 169
HIS A 245
SER A 283
VAL A 166
 PO4  A 301 (-4.6A)
None
None
None
 1.29A 1u1jA-5ej2A:
2.2		 1u1jA-5ej2A:
19.17
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.
1UAY_A_ADNA1001_1
(TYPE II
3-HYDROXYACYL-COA
DEHYDROGENASE)		 5ej2 CARVEOL
DEHYDROGENASE
(Mycobacterium
avium) 		7 / 11 GLY A  22
ALA A  24
ASP A  46
ASP A  84
VAL A  85
ALA A 112
VAL A 114
 NAD  A 300 (-3.5A)
NAD  A 300 ( 3.8A)
NAD  A 300 (-2.7A)
NAD  A 300 (-3.3A)
NAD  A 300 (-3.6A)
NAD  A 300 (-3.6A)
NAD  A 300 (-4.8A)
 0.28A 1uayA-5ej2A:
29.4		 1uayA-5ej2A:
25.94
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.
1UAY_B_ADNB1002_1
(TYPE II
3-HYDROXYACYL-COA
DEHYDROGENASE)		 5ej2 CARVEOL
DEHYDROGENASE
(Mycobacterium
avium) 		7 / 10 GLY A  22
ALA A  24
ASP A  46
ASP A  84
VAL A  85
ALA A 112
VAL A 114
 NAD  A 300 (-3.5A)
NAD  A 300 ( 3.8A)
NAD  A 300 (-2.7A)
NAD  A 300 (-3.3A)
NAD  A 300 (-3.6A)
NAD  A 300 (-3.6A)
NAD  A 300 (-4.8A)
 0.28A 1uayB-5ej2A:
29.5		 1uayB-5ej2A:
25.94
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.
2BM9_E_SAME301_0
(CEPHALOSPORIN
HYDROXYLASE CMCI)		 5ej2 CARVEOL
DEHYDROGENASE
(Mycobacterium
avium) 		5 / 12 GLY A  22
ASP A  46
ASP A  84
ASN A 111
ALA A 112
 NAD  A 300 (-3.5A)
NAD  A 300 (-2.7A)
NAD  A 300 (-3.3A)
NAD  A 300 (-3.4A)
NAD  A 300 (-3.6A)
 0.95A 2bm9E-5ej2A:
2.4		 2bm9E-5ej2A:
20.98
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.
2QE6_A_SAMA400_0
(UNCHARACTERIZED
PROTEIN TFU_2867)		 5ej2 CARVEOL
DEHYDROGENASE
(Mycobacterium
avium) 		5 / 12 GLY A  22
ILE A  47
ASP A  84
VAL A  85
ARG A  86
 NAD  A 300 (-3.5A)
NAD  A 300 (-3.8A)
NAD  A 300 (-3.3A)
NAD  A 300 (-3.6A)
NAD  A 300 ( 4.8A)
 0.83A 2qe6A-5ej2A:
undetectable		 2qe6A-5ej2A:
22.98
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.
2QE6_B_SAMB400_0
(UNCHARACTERIZED
PROTEIN TFU_2867)		 5ej2 CARVEOL
DEHYDROGENASE
(Mycobacterium
avium) 		5 / 12 ALA A  24
ILE A  47
ASP A  84
VAL A  85
VAL A 109
 NAD  A 300 ( 3.8A)
NAD  A 300 (-3.8A)
NAD  A 300 (-3.3A)
NAD  A 300 (-3.6A)
None
 1.06A 2qe6B-5ej2A:
undetectable		 2qe6B-5ej2A:
22.98
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.
2X2I_C_QPSC1060_1
(ALPHA-1,4-GLUCAN
LYASE ISOZYME 1)		 5ej2 CARVEOL
DEHYDROGENASE
(Mycobacterium
avium) 		5 / 12 VAL A  71
SER A 258
ASN A 111
VAL A 109
ALA A  18
 None
None
NAD  A 300 (-3.4A)
None
None
 1.23A 2x2iC-5ej2A:
undetectable		 2x2iC-5ej2A:
15.85
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.
3AY0_A_ADNA401_1
(UNCHARACTERIZED
PROTEIN MJ0883)		 5ej2 CARVEOL
DEHYDROGENASE
(Mycobacterium
avium) 		5 / 10 ASP A  46
ILE A  47
ALA A  24
ASP A  84
VAL A  85
 NAD  A 300 (-2.7A)
NAD  A 300 (-3.8A)
NAD  A 300 ( 3.8A)
NAD  A 300 (-3.3A)
NAD  A 300 (-3.6A)
 0.81A 3ay0A-5ej2A:
6.4		 3ay0A-5ej2A:
19.77
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.
3BJ8_C_SPMC500_1
(DIAMINE
ACETYLTRANSFERASE 1)		 5ej2 CARVEOL
DEHYDROGENASE
(Mycobacterium
avium) 		4 / 6 ASP A  84
LEU A  91
ASP A  46
LEU A  64
 NAD  A 300 (-3.3A)
None
NAD  A 300 (-2.7A)
None
 1.20A 3bj8C-5ej2A:
undetectable
3bj8D-5ej2A:
undetectable		 3bj8C-5ej2A:
18.59
3bj8D-5ej2A:
18.59
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.
3R9C_A_ECLA451_1
(CYTOCHROME P450
164A2)		 5ej2 CARVEOL
DEHYDROGENASE
(Mycobacterium
avium) 		5 / 10 ALA A 110
ILE A  45
ALA A  81
VAL A  71
THR A  67
 None
 1.36A 3r9cA-5ej2A:
undetectable		 3r9cA-5ej2A:
22.02
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.
4Q5M_A_ROCA1101_1
(PROTEASE)		 5ej2 CARVEOL
DEHYDROGENASE
(Mycobacterium
avium) 		6 / 12 GLY A 115
ILE A  47
VAL A 140
VAL A 211
ILE A 257
THR A 213
 None
NAD  A 300 (-3.8A)
None
NAD  A 300 (-4.2A)
None
NAD  A 300 (-2.6A)
 1.10A 4q5mA-5ej2A:
undetectable		 4q5mA-5ej2A:
20.92
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.
4QYN_A_RTLA201_0
(RETINOL-BINDING
PROTEIN 2)		 5ej2 CARVEOL
DEHYDROGENASE
(Mycobacterium
avium) 		5 / 12 ILE A  42
ALA A  23
THR A 143
VAL A 148
LEU A 162
 None
 1.27A 4qynA-5ej2A:
undetectable		 4qynA-5ej2A:
17.10
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.
5LJE_A_RTLA201_1
(RETINOL-BINDING
PROTEIN 1)		 5ej2 CARVEOL
DEHYDROGENASE
(Mycobacterium
avium) 		4 / 6 LEU A 207
ILE A 135
MET A 132
MET A 215
 None
NAD  A 300 (-3.8A)
None
NAD  A 300 (-3.6A)
 1.34A 5ljeA-5ej2A:
undetectable		 5ljeA-5ej2A:
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.
5NZY_A_CE3A1103_1
(DNA CROSS-LINK
REPAIR 1A PROTEIN)		 5ej2 CARVEOL
DEHYDROGENASE
(Mycobacterium
avium) 		4 / 8 THR A 175
ASP A 134
VAL A 185
GLY A 184
 MPD  A 302 ( 4.2A)
None
None
None
 0.82A 5nzyA-5ej2A:
undetectable		 5nzyA-5ej2A:
20.33
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.
6H1L_B_FJQB501_0
(BIFUNCTIONAL
CYTOCHROME
P450/NADPH--P450
REDUCTASE)		 5ej2 CARVEOL
DEHYDROGENASE
(Mycobacterium
avium) 		5 / 11 ALA A 205
LEU A 162
VAL A 144
ILE A 201
ALA A 191
 None
 0.95A 6h1lB-5ej2A:
undetectable		 6h1lB-5ej2A:
21.09