SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4jat'

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.
1EIZ_A_SAMA301_0
(FTSJ)		 4jat ALPHA-PYRONE
SYNTHESIS POLYKETIDE
SYNTHASE-LIKE PKS11
(Mycobacterium
tuberculosis) 		5 / 12 GLY A 108
GLY A 236
LEU A 167
LEU A 170
LEU A 114
 None
 0.83A 1eizA-4jatA:
undetectable		 1eizA-4jatA:
22.73
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.
1EJ0_A_SAMA301_0
(FTSJ)		 4jat ALPHA-PYRONE
SYNTHESIS POLYKETIDE
SYNTHASE-LIKE PKS11
(Mycobacterium
tuberculosis) 		5 / 12 GLY A 108
GLY A 236
LEU A 167
LEU A 170
LEU A 114
 None
 0.81A 1ej0A-4jatA:
undetectable		 1ej0A-4jatA:
22.73
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.
1KT4_A_RTLA184_0
(PLASMA
RETINOL-BINDING
PROTEIN)		 4jat ALPHA-PYRONE
SYNTHESIS POLYKETIDE
SYNTHASE-LIKE PKS11
(Mycobacterium
tuberculosis) 		5 / 12 LEU A  79
LEU A 114
ALA A 110
VAL A 165
ARG A 121
 None
 1.18A 1kt4A-4jatA:
undetectable		 1kt4A-4jatA:
19.69
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.
2HDN_J_TACJ5888_1
(ELONGATION FACTOR
EF-TU)		 4jat ALPHA-PYRONE
SYNTHESIS POLYKETIDE
SYNTHASE-LIKE PKS11
(Mycobacterium
tuberculosis) 		4 / 6 SER A 138
PRO A 341
SER A 312
VAL A 106
 PLM  A 400 (-2.9A)
PLM  A 400 ( 4.5A)
PLM  A 400 (-2.5A)
None
 1.17A 2hdnI-4jatA:
undetectable
2hdnJ-4jatA:
undetectable
2hdnL-4jatA:
undetectable		 2hdnI-4jatA:
7.83
2hdnJ-4jatA:
21.83
2hdnL-4jatA:
21.83
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.
2HDN_L_TACL6888_1
(ELONGATION FACTOR
EF-TU)		 4jat ALPHA-PYRONE
SYNTHESIS POLYKETIDE
SYNTHASE-LIKE PKS11
(Mycobacterium
tuberculosis) 		4 / 6 SER A 312
VAL A 106
SER A 138
PRO A 341
 PLM  A 400 (-2.5A)
None
PLM  A 400 (-2.9A)
PLM  A 400 ( 4.5A)
 1.20A 2hdnJ-4jatA:
undetectable
2hdnK-4jatA:
undetectable
2hdnL-4jatA:
undetectable		 2hdnJ-4jatA:
21.83
2hdnK-4jatA:
7.83
2hdnL-4jatA:
21.83
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.
2IGT_C_SAMC1003_1
(SAM DEPENDENT
METHYLTRANSFERASE)		 4jat ALPHA-PYRONE
SYNTHESIS POLYKETIDE
SYNTHASE-LIKE PKS11
(Mycobacterium
tuberculosis) 		4 / 4 ASP A 157
ASP A 200
ASP A  99
GLY A 154
 None
 1.48A 2igtC-4jatA:
undetectable		 2igtC-4jatA:
23.68
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.
2NYU_B_SAMB201_0
(PUTATIVE RIBOSOMAL
RNA
METHYLTRANSFERASE 2)		 4jat ALPHA-PYRONE
SYNTHESIS POLYKETIDE
SYNTHASE-LIKE PKS11
(Mycobacterium
tuberculosis) 		5 / 12 GLY A 108
GLY A 236
LEU A 167
LEU A 170
LEU A 114
 None
 0.87A 2nyuB-4jatA:
undetectable		 2nyuB-4jatA:
19.66
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.
2UXP_B_CLMB1211_0
(HTH-TYPE
TRANSCRIPTIONAL
REGULATOR TTGR)		 4jat ALPHA-PYRONE
SYNTHESIS POLYKETIDE
SYNTHASE-LIKE PKS11
(Mycobacterium
tuberculosis) 		5 / 11 ALA A 297
VAL A 287
GLY A 272
ILE A 271
VAL A 257
 None
 1.18A 2uxpB-4jatA:
undetectable		 2uxpB-4jatA:
21.33
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.
2ZZM_A_SAMA401_1
(UNCHARACTERIZED
PROTEIN MJ0883)		 4jat ALPHA-PYRONE
SYNTHESIS POLYKETIDE
SYNTHASE-LIKE PKS11
(Mycobacterium
tuberculosis) 		3 / 3 ARG A 207
ASP A  97
ASN A  92
 None
 0.61A 2zzmA-4jatA:
undetectable		 2zzmA-4jatA:
21.39
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.
3JB2_A_SAMA1101_0
(STRUCTURAL PROTEIN
VP3)		 4jat ALPHA-PYRONE
SYNTHESIS POLYKETIDE
SYNTHASE-LIKE PKS11
(Mycobacterium
tuberculosis) 		5 / 12 SER A 332
GLY A 210
VAL A   7
ILE A 324
GLU A 325
 None
 1.47A 3jb2A-4jatA:
undetectable		 3jb2A-4jatA:
16.24
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.
3SFE_C_TMGC1_1
(SUCCINATE
DEHYDROGENASE
[UBIQUINONE]
IRON-SULFUR SUBUNIT,
MITOCHONDRIAL
SUCCINATE
DEHYDROGENASE
CYTOCHROME B560
SUBUNIT,
MITOCHONDRIAL)		 4jat ALPHA-PYRONE
SYNTHESIS POLYKETIDE
SYNTHASE-LIKE PKS11
(Mycobacterium
tuberculosis) 		4 / 8 HIS A 318
TRP A 352
ILE A 324
ARG A 321
 None
 1.10A 3sfeB-4jatA:
undetectable
3sfeC-4jatA:
undetectable		 3sfeB-4jatA:
19.39
3sfeC-4jatA:
20.06
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.
4ENH_A_FVXA602_1
(CHOLESTEROL
24-HYDROXYLASE)		 4jat ALPHA-PYRONE
SYNTHESIS POLYKETIDE
SYNTHASE-LIKE PKS11
(Mycobacterium
tuberculosis) 		5 / 12 LEU A  84
ALA A 160
ALA A   5
GLY A 209
ALA A  87
 None
 1.04A 4enhA-4jatA:
undetectable		 4enhA-4jatA:
23.83
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.
4ENH_A_FVXA602_1
(CHOLESTEROL
24-HYDROXYLASE)		 4jat ALPHA-PYRONE
SYNTHESIS POLYKETIDE
SYNTHASE-LIKE PKS11
(Mycobacterium
tuberculosis) 		5 / 12 LEU A  84
ALA A 160
ALA A   5
GLY A 210
ALA A  87
 None
 0.93A 4enhA-4jatA:
undetectable		 4enhA-4jatA:
23.83
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.
4J24_D_ESTD600_1
(ESTROGEN RECEPTOR
BETA)		 4jat ALPHA-PYRONE
SYNTHESIS POLYKETIDE
SYNTHASE-LIKE PKS11
(Mycobacterium
tuberculosis) 		5 / 12 ALA A 143
MET A 336
ILE A   4
LEU A 350
LEU A 162
 None
 1.20A 4j24D-4jatA:
undetectable		 4j24D-4jatA:
23.12
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.
4UUU_B_SAMB1548_0
(CYSTATHIONINE
BETA-SYNTHASE)		 4jat ALPHA-PYRONE
SYNTHESIS POLYKETIDE
SYNTHASE-LIKE PKS11
(Mycobacterium
tuberculosis) 		5 / 11 LEU A  84
ASP A  78
ALA A  83
VAL A 165
ILE A  73
 None
 1.25A 4uuuB-4jatA:
undetectable		 4uuuB-4jatA:
18.34
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.
4WNW_A_RTZA602_1
(CYTOCHROME P450 2D6)		 4jat ALPHA-PYRONE
SYNTHESIS POLYKETIDE
SYNTHASE-LIKE PKS11
(Mycobacterium
tuberculosis) 		5 / 12 PHE A  72
LEU A 114
GLY A 135
LEU A 136
SER A 313
 None
 1.20A 4wnwA-4jatA:
undetectable		 4wnwA-4jatA:
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.
5DZK_S_BEZS801_0
(ATP-DEPENDENT CLP
PROTEASE PROTEOLYTIC
SUBUNIT 2
BEZ-LEU-LEU)		 4jat ALPHA-PYRONE
SYNTHESIS POLYKETIDE
SYNTHASE-LIKE PKS11
(Mycobacterium
tuberculosis) 		4 / 6 SER A 138
HIS A 277
MET A 228
LEU A 187
 PLM  A 400 (-2.9A)
None
PLM  A 400 ( 4.8A)
None
 1.33A 5dzke-4jatA:
undetectable
5dzks-4jatA:
undetectable		 5dzke-4jatA:
24.58
5dzks-4jatA:
2.35
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.
6DM0_D_CYZD1302_0
(GLUTAMATE RECEPTOR
2,VOLTAGE-DEPENDENT
CALCIUM CHANNEL
GAMMA-2 SUBUNIT)		 4jat ALPHA-PYRONE
SYNTHESIS POLYKETIDE
SYNTHASE-LIKE PKS11
(Mycobacterium
tuberculosis) 		5 / 9 PRO A 341
GLY A 229
SER A 312
LEU A 245
LEU A 187
 PLM  A 400 ( 4.5A)
None
PLM  A 400 (-2.5A)
None
None
 1.49A 6dm0A-4jatA:
undetectable
6dm0D-4jatA:
undetectable		 6dm0A-4jatA:
11.01
6dm0D-4jatA:
11.01