SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '1l1e'

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.
1DVX_B_DIFB125_2
(TRANSTHYRETIN)
1l1e MYCOLIC ACID
SYNTHASE

(Mycobacterium
tuberculosis)
4 / 7 LEU A 285
SER A 135
THR A 168
VAL A 170
None
1.00A 1dvxB-1l1eA:
undetectable
1dvxB-1l1eA:
20.71
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.
1J36_A_LPRA801_1
(ANGIOTENSIN
CONVERTING ENZYME)
1l1e MYCOLIC ACID
SYNTHASE

(Mycobacterium
tuberculosis)
5 / 12 GLN A  49
HIS A 167
GLU A 140
HIS A 141
LYS A  52
None
CO3  A 903 (-3.9A)
CO3  A 903 (-3.1A)
SAH  A 900 ( 4.8A)
SAH  A 900 ( 4.7A)
1.48A 1j36A-1l1eA:
undetectable
1j36A-1l1eA:
17.97
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.
1J36_B_LPRB802_1
(ANGIOTENSIN
CONVERTING ENZYME)
1l1e MYCOLIC ACID
SYNTHASE

(Mycobacterium
tuberculosis)
5 / 12 GLN A  49
HIS A 167
GLU A 140
HIS A 141
LYS A  52
None
CO3  A 903 (-3.9A)
CO3  A 903 (-3.1A)
SAH  A 900 ( 4.8A)
SAH  A 900 ( 4.7A)
1.48A 1j36B-1l1eA:
undetectable
1j36B-1l1eA:
17.97
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.
1WG8_B_SAMB3141_1
(PREDICTED
S-ADENOSYLMETHIONINE
-DEPENDENT
METHYLTRANSFERASE)
1l1e MYCOLIC ACID
SYNTHASE

(Mycobacterium
tuberculosis)
3 / 3 HIS A 102
ASP A  21
ASN A 246
None
0.70A 1wg8B-1l1eA:
14.7
1wg8B-1l1eA:
24.85
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.
1XVA_A_SAMA293_0
(GLYCINE
N-METHYLTRANSFERASE)
1l1e MYCOLIC ACID
SYNTHASE

(Mycobacterium
tuberculosis)
5 / 12 ASP A  20
GLY A 137
ILE A 169
TYR A 232
TYR A 265
None
CO3  A 903 ( 3.5A)
CO3  A 903 (-4.8A)
CO3  A 903 (-4.7A)
None
1.18A 1xvaA-1l1eA:
14.0
1xvaA-1l1eA:
22.05
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.
2C6N_B_LPRB705_1
(ANGIOTENSIN-CONVERTI
NG ENZYME, SOMATIC
ISOFORM)
1l1e MYCOLIC ACID
SYNTHASE

(Mycobacterium
tuberculosis)
5 / 12 GLN A  49
HIS A 167
GLU A 140
HIS A 141
LYS A  52
None
CO3  A 903 (-3.9A)
CO3  A 903 (-3.1A)
SAH  A 900 ( 4.8A)
SAH  A 900 ( 4.7A)
1.48A 2c6nB-1l1eA:
undetectable
2c6nB-1l1eA:
18.95
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2FK8_A_SAMA302_0
(METHOXY MYCOLIC ACID
SYNTHASE 4)
1l1e MYCOLIC ACID
SYNTHASE

(Mycobacterium
tuberculosis)
12 / 12 THR A  32
TYR A  33
ILE A  71
GLY A  72
GLY A  74
LEU A  95
GLY A 122
TRP A 123
GLU A 124
ILE A 136
ALA A 138
HIS A 141
SAH  A 900 (-4.1A)
None
None
SAH  A 900 (-3.1A)
SAH  A 900 (-3.4A)
SAH  A 900 (-4.1A)
SAH  A 900 (-3.2A)
SAH  A 900 (-4.3A)
SAH  A 900 (-3.7A)
SAH  A 900 (-3.9A)
SAH  A 900 (-3.4A)
SAH  A 900 ( 4.8A)
0.58A 2fk8A-1l1eA:
39.9
2fk8A-1l1eA:
51.12
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2FK8_A_SAMA302_1
(METHOXY MYCOLIC ACID
SYNTHASE 4)
1l1e MYCOLIC ACID
SYNTHASE

(Mycobacterium
tuberculosis)
3 / 3 SER A  34
THR A  94
GLN A  99
SAH  A 900 ( 2.7A)
SAH  A 900 (-4.4A)
SAH  A 900 (-3.1A)
0.16A 2fk8A-1l1eA:
39.9
2fk8A-1l1eA:
51.12
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.
2GLU_A_SAMA301_0
(YCGJ)
1l1e MYCOLIC ACID
SYNTHASE

(Mycobacterium
tuberculosis)
5 / 12 GLY A  72
GLY A  74
THR A  78
GLU A 124
HIS A 141
SAH  A 900 (-3.1A)
SAH  A 900 (-3.4A)
None
SAH  A 900 (-3.7A)
SAH  A 900 ( 4.8A)
0.93A 2gluA-1l1eA:
18.1
2gluA-1l1eA:
22.58
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.
2GLU_B_SAMB302_0
(YCGJ)
1l1e MYCOLIC ACID
SYNTHASE

(Mycobacterium
tuberculosis)
5 / 12 GLY A  72
GLY A  74
ALA A 138
HIS A 141
PHE A 142
SAH  A 900 (-3.1A)
SAH  A 900 (-3.4A)
SAH  A 900 (-3.4A)
SAH  A 900 ( 4.8A)
SAH  A 900 ( 4.7A)
0.80A 2gluB-1l1eA:
18.1
2gluB-1l1eA:
22.58
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.
2HW2_A_RFPA1200_1
(RIFAMPIN ADP-RIBOSYL
TRANSFERASE)
1l1e MYCOLIC ACID
SYNTHASE

(Mycobacterium
tuberculosis)
5 / 12 GLY A  72
THR A  32
SER A  34
LEU A  68
LEU A  62
SAH  A 900 (-3.1A)
SAH  A 900 (-4.1A)
SAH  A 900 ( 2.7A)
None
None
0.99A 2hw2A-1l1eA:
0.0
2hw2A-1l1eA:
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.
2X91_A_LPRA1615_1
(ANGIOTENSIN
CONVERTING ENZYME)
1l1e MYCOLIC ACID
SYNTHASE

(Mycobacterium
tuberculosis)
5 / 12 GLN A  49
HIS A 167
GLU A 140
HIS A 141
LYS A  52
None
CO3  A 903 (-3.9A)
CO3  A 903 (-3.1A)
SAH  A 900 ( 4.8A)
SAH  A 900 ( 4.7A)
1.49A 2x91A-1l1eA:
undetectable
2x91A-1l1eA:
17.85
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.
3D2T_A_1FLA502_1
(TRANSTHYRETIN)
1l1e MYCOLIC ACID
SYNTHASE

(Mycobacterium
tuberculosis)
4 / 7 LEU A 285
SER A 135
THR A 168
VAL A 170
None
0.97A 3d2tA-1l1eA:
undetectable
3d2tA-1l1eA:
19.35
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.
3G2O_A_SAMA500_0
(PCZA361.24)
1l1e MYCOLIC ACID
SYNTHASE

(Mycobacterium
tuberculosis)
5 / 12 GLY A  74
LEU A  93
LEU A  95
SER A  96
GLY A 137
SAH  A 900 (-3.4A)
None
SAH  A 900 (-4.1A)
None
CO3  A 903 ( 3.5A)
1.08A 3g2oA-1l1eA:
16.2
3g2oA-1l1eA:
21.76
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.
3SI7_B_ACTB4_0
(CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR)
1l1e MYCOLIC ACID
SYNTHASE

(Mycobacterium
tuberculosis)
3 / 3 GLY A  74
GLY A  76
THR A  78
SAH  A 900 (-3.4A)
None
None
0.23A 3si7B-1l1eA:
undetectable
3si7B-1l1eA:
23.05
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.
4F84_A_SAMA501_0
(GERANYL DIPHOSPHATE
2-C-METHYLTRANSFERAS
E)
1l1e MYCOLIC ACID
SYNTHASE

(Mycobacterium
tuberculosis)
5 / 12 GLY A  72
GLY A  74
THR A  94
LEU A  95
GLN A  99
SAH  A 900 (-3.1A)
SAH  A 900 (-3.4A)
SAH  A 900 (-4.4A)
SAH  A 900 (-4.1A)
SAH  A 900 (-3.1A)
0.46A 4f84A-1l1eA:
25.4
4f84A-1l1eA:
21.25
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.
4IAQ_A_2GMA2001_1
(CHIMERA PROTEIN OF
HUMAN
5-HYDROXYTRYPTAMINE
RECEPTOR 1B AND E.
COLI SOLUBLE
CYTOCHROME B562)
1l1e MYCOLIC ACID
SYNTHASE

(Mycobacterium
tuberculosis)
5 / 12 LEU A 165
PHE A 150
PHE A 142
PHE A 151
THR A 154
None
None
SAH  A 900 ( 4.7A)
None
None
1.17A 4iaqA-1l1eA:
undetectable
4iaqA-1l1eA:
19.58
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.
4KRH_A_SAMA900_0
(PHOSPHOETHANOLAMINE
N-METHYLTRANSFERASE
2)
1l1e MYCOLIC ACID
SYNTHASE

(Mycobacterium
tuberculosis)
5 / 12 GLY A  72
GLY A  74
LEU A  95
SER A  96
HIS A 141
SAH  A 900 (-3.1A)
SAH  A 900 (-3.4A)
SAH  A 900 (-4.1A)
None
SAH  A 900 ( 4.8A)
0.81A 4krhA-1l1eA:
26.1
4krhA-1l1eA:
19.34
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.
4KRH_B_SAMB900_0
(PHOSPHOETHANOLAMINE
N-METHYLTRANSFERASE
2)
1l1e MYCOLIC ACID
SYNTHASE

(Mycobacterium
tuberculosis)
5 / 12 GLY A  72
GLY A  74
LEU A  95
SER A  96
HIS A 141
SAH  A 900 (-3.1A)
SAH  A 900 (-3.4A)
SAH  A 900 (-4.1A)
None
SAH  A 900 ( 4.8A)
0.76A 4krhB-1l1eA:
26.2
4krhB-1l1eA:
19.34
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.
4QTU_B_SAMB301_0
(PUTATIVE
METHYLTRANSFERASE
BUD23)
1l1e MYCOLIC ACID
SYNTHASE

(Mycobacterium
tuberculosis)
6 / 12 GLY A  72
GLY A  74
SER A  96
ILE A 136
ALA A 138
ARG A 146
SAH  A 900 (-3.1A)
SAH  A 900 (-3.4A)
None
SAH  A 900 (-3.9A)
SAH  A 900 (-3.4A)
SAH  A 900 (-4.6A)
0.87A 4qtuB-1l1eA:
16.7
4qtuB-1l1eA:
22.30
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.
4QTU_B_SAMB301_0
(PUTATIVE
METHYLTRANSFERASE
BUD23)
1l1e MYCOLIC ACID
SYNTHASE

(Mycobacterium
tuberculosis)
5 / 12 GLY A  74
GLY A  72
LEU A  95
ILE A 136
SER A 135
SAH  A 900 (-3.4A)
SAH  A 900 (-3.1A)
SAH  A 900 (-4.1A)
SAH  A 900 (-3.9A)
None
1.11A 4qtuB-1l1eA:
16.7
4qtuB-1l1eA:
22.30
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.
4QTU_D_SAMD301_0
(PUTATIVE
METHYLTRANSFERASE
BUD23)
1l1e MYCOLIC ACID
SYNTHASE

(Mycobacterium
tuberculosis)
6 / 12 GLY A  72
GLY A  74
SER A  96
ILE A 136
ALA A 138
ARG A 146
SAH  A 900 (-3.1A)
SAH  A 900 (-3.4A)
None
SAH  A 900 (-3.9A)
SAH  A 900 (-3.4A)
SAH  A 900 (-4.6A)
0.84A 4qtuD-1l1eA:
17.1
4qtuD-1l1eA:
22.30
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.
4UCI_A_SAMA2409_0
(RNA-DIRECTED RNA
POLYMERASE L)
1l1e MYCOLIC ACID
SYNTHASE

(Mycobacterium
tuberculosis)
5 / 12 GLY A  72
GLY A  74
GLY A  76
LEU A  95
ALA A 138
SAH  A 900 (-3.1A)
SAH  A 900 (-3.4A)
None
SAH  A 900 (-4.1A)
SAH  A 900 (-3.4A)
0.89A 4uciA-1l1eA:
6.8
4uciA-1l1eA:
22.82
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.
4UCI_B_SAMB2409_0
(RNA-DIRECTED RNA
POLYMERASE L)
1l1e MYCOLIC ACID
SYNTHASE

(Mycobacterium
tuberculosis)
5 / 12 GLY A  72
GLY A  74
GLY A  76
LEU A  95
ALA A 138
SAH  A 900 (-3.1A)
SAH  A 900 (-3.4A)
None
SAH  A 900 (-4.1A)
SAH  A 900 (-3.4A)
0.88A 4uciB-1l1eA:
5.2
4uciB-1l1eA:
22.82
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.
4UCK_A_SAMA2409_0
(RNA-DIRECTED RNA
POLYMERASE L)
1l1e MYCOLIC ACID
SYNTHASE

(Mycobacterium
tuberculosis)
5 / 12 GLY A  72
GLY A  74
GLY A  76
LEU A  95
ALA A 138
SAH  A 900 (-3.1A)
SAH  A 900 (-3.4A)
None
SAH  A 900 (-4.1A)
SAH  A 900 (-3.4A)
0.91A 4uckA-1l1eA:
6.6
4uckA-1l1eA:
22.82
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)
1l1e MYCOLIC ACID
SYNTHASE

(Mycobacterium
tuberculosis)
5 / 12 PHE A 191
LEU A 236
LEU A 266
PHE A 200
THR A 278
None
1.33A 5ieoA-1l1eA:
0.0
5ieoA-1l1eA:
18.06
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.
5JI0_A_9CRA501_1
(RETINOIC ACID
RECEPTOR RXR-ALPHA)
1l1e MYCOLIC ACID
SYNTHASE

(Mycobacterium
tuberculosis)
5 / 11 ILE A 169
TRP A 239
PHE A 200
ALA A 138
CYH A 269
CO3  A 903 (-4.8A)
None
None
SAH  A 900 (-3.4A)
None
1.23A 5ji0A-1l1eA:
undetectable
5ji0A-1l1eA:
23.78
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.
5KOC_B_SAMB401_0
(PAVINE
N-METHYLTRANSFERASE)
1l1e MYCOLIC ACID
SYNTHASE

(Mycobacterium
tuberculosis)
6 / 12 SER A  34
GLY A  72
GLY A  74
THR A  94
GLN A  99
HIS A 141
SAH  A 900 ( 2.7A)
SAH  A 900 (-3.1A)
SAH  A 900 (-3.4A)
SAH  A 900 (-4.4A)
SAH  A 900 (-3.1A)
SAH  A 900 ( 4.8A)
0.52A 5kocB-1l1eA:
28.2
5kocB-1l1eA:
22.44
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.
5KPC_B_SAMB401_0
(PAVINE
N-METHYLTRANSFERASE)
1l1e MYCOLIC ACID
SYNTHASE

(Mycobacterium
tuberculosis)
5 / 12 SER A  34
GLY A  72
GLY A  74
SER A  96
GLN A  99
SAH  A 900 ( 2.7A)
SAH  A 900 (-3.1A)
SAH  A 900 (-3.4A)
None
SAH  A 900 (-3.1A)
0.72A 5kpcB-1l1eA:
28.5
5kpcB-1l1eA:
22.20
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.
5U6M_A_SALA503_1
(UDP-GLYCOSYLTRANSFER
ASE 74F2)
1l1e MYCOLIC ACID
SYNTHASE

(Mycobacterium
tuberculosis)
4 / 7 THR A 154
PHE A 142
MET A 164
THR A 168
None
SAH  A 900 ( 4.7A)
None
None
1.36A 5u6mA-1l1eA:
2.2
5u6mA-1l1eA:
20.09
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.
6NKN_J_CHDJ101_0
(CYTOCHROME C OXIDASE
SUBUNIT 3
CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)
1l1e MYCOLIC ACID
SYNTHASE

(Mycobacterium
tuberculosis)
3 / 3 ARG A 146
PHE A 126
PHE A 142
SAH  A 900 (-4.6A)
None
SAH  A 900 ( 4.7A)
1.06A 6nknC-1l1eA:
0.0
6nknJ-1l1eA:
0.0
6nknC-1l1eA:
23.29
6nknJ-1l1eA:
12.54