SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '5j5d'

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.
1FO4_B_SALB4005_1
(XANTHINE
DEHYDROGENASE)		 5j5d 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
SYNTHASE
(Mycobacterium
tuberculosis) 		4 / 7 SER A 149
THR A 114
VAL A 113
ALA A 173
 None
 1.03A 1fo4B-5j5dA:
undetectable		 1fo4B-5j5dA:
13.21
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.
1KF6_N_ACTN803_0
(FUMARATE REDUCTASE
FLAVOPROTEIN
FUMARATE REDUCTASE
IRON-SULFUR PROTEIN)		 5j5d 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
SYNTHASE
(Mycobacterium
tuberculosis) 		4 / 6 ARG A 223
GLY A  13
ASP A  47
TYR A 192
 None
 1.17A 1kf6M-5j5dA:
0.4
1kf6N-5j5dA:
undetectable		 1kf6M-5j5dA:
19.38
1kf6N-5j5dA:
24.19
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.
1KIA_A_SAMA293_0
(GLYCINE
N-METHYLTRANSFERASE)		 5j5d 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
SYNTHASE
(Mycobacterium
tuberculosis) 		5 / 12 ILE A 211
GLY A 109
VAL A  50
GLY A  13
TYR A 192
 None
 1.10A 1kiaA-5j5dA:
undetectable		 1kiaA-5j5dA:
24.70
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.
1KIA_B_SAMB1293_0
(GLYCINE
N-METHYLTRANSFERASE)		 5j5d 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
SYNTHASE
(Mycobacterium
tuberculosis) 		5 / 12 ILE A 211
GLY A 109
VAL A  50
GLY A  13
TYR A 192
 None
 1.08A 1kiaB-5j5dA:
2.0		 1kiaB-5j5dA:
24.70
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.
1KIA_C_SAMC2293_0
(GLYCINE
N-METHYLTRANSFERASE)		 5j5d 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
SYNTHASE
(Mycobacterium
tuberculosis) 		5 / 12 ILE A 211
GLY A 109
VAL A  50
GLY A  13
TYR A 192
 None
 1.09A 1kiaC-5j5dA:
undetectable		 1kiaC-5j5dA:
24.70
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.
1NBH_B_SAMB1293_0
(GLYCINE
N-METHYLTRANSFERASE)		 5j5d 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
SYNTHASE
(Mycobacterium
tuberculosis) 		5 / 12 ILE A 211
GLY A 109
VAL A  50
GLY A  13
TYR A 192
 None
 1.10A 1nbhB-5j5dA:
undetectable		 1nbhB-5j5dA:
24.70
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.
2FK8_A_SAMA302_1
(METHOXY MYCOLIC ACID
SYNTHASE 4)		 5j5d 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
SYNTHASE
(Mycobacterium
tuberculosis) 		3 / 3 SER A 149
THR A 157
GLN A 122
 None
 0.79A 2fk8A-5j5dA:
undetectable		 2fk8A-5j5dA:
21.96
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.
2QL8_A_BEZA143_0
(PUTATIVE REDOX
PROTEIN)		 5j5d 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
SYNTHASE
(Mycobacterium
tuberculosis) 		4 / 7 ALA A  34
THR A  31
ALA A  72
ARG A  71
 None
 0.96A 2ql8A-5j5dA:
undetectable
2ql8B-5j5dA:
undetectable		 2ql8A-5j5dA:
20.15
2ql8B-5j5dA:
20.15
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.
3C6G_B_VD3B700_1
(CYTOCHROME P450 2R1)		 5j5d 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
SYNTHASE
(Mycobacterium
tuberculosis) 		5 / 12 LEU A 264
ALA A  38
ALA A  32
GLY A 272
THR A  55
 None
None
None
None
6GT  A 403 (-3.7A)
 1.07A 3c6gB-5j5dA:
undetectable		 3c6gB-5j5dA:
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.
3DH0_B_SAMB300_0
(SAM DEPENDENT
METHYLTRANSFERASE)		 5j5d 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
SYNTHASE
(Mycobacterium
tuberculosis) 		5 / 12 PHE A 210
LEU A 226
GLY A  13
ALA A   9
LEU A 141
 None
 1.01A 3dh0B-5j5dA:
undetectable		 3dh0B-5j5dA:
22.00
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.
3DL9_A_V2HA602_1
(CYTOCHROME P450 2R1)		 5j5d 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
SYNTHASE
(Mycobacterium
tuberculosis) 		4 / 5 ALA A 280
LEU A 289
GLY A 263
THR A  17
 None
 0.83A 3dl9A-5j5dA:
undetectable		 3dl9A-5j5dA:
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.
4M11_A_MXMA606_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 5j5d 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
SYNTHASE
(Mycobacterium
tuberculosis) 		5 / 12 MET A 251
LEU A 259
LEU A  15
ALA A 218
LEU A 217
 6GT  A 403 ( 4.4A)
None
None
None
None
 1.26A 4m11A-5j5dA:
undetectable		 4m11A-5j5dA:
19.89
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.
4MM9_A_FVXA603_1
(TRANSPORTER)		 5j5d 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
SYNTHASE
(Mycobacterium
tuberculosis) 		5 / 11 TYR A 191
ASP A 144
GLY A 180
GLY A 169
ASP A 156
 None
None
None
None
NA  A 402 (-3.3A)
 1.29A 4mm9A-5j5dA:
undetectable		 4mm9A-5j5dA:
21.13
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.
4Y8W_A_STRA604_1
(CYTOCHROME P450
21-HYDROXYLASE)		 5j5d 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
SYNTHASE
(Mycobacterium
tuberculosis) 		5 / 12 VAL A 244
ASP A 196
SER A 212
VAL A 298
LEU A  15
 None
 0.88A 4y8wA-5j5dA:
undetectable		 4y8wA-5j5dA:
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.
4Y8W_B_STRB603_1
(CYTOCHROME P450
21-HYDROXYLASE)		 5j5d 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
SYNTHASE
(Mycobacterium
tuberculosis) 		5 / 12 VAL A 244
ASP A 196
SER A 212
VAL A 298
LEU A  15
 None
 0.95A 4y8wB-5j5dA:
undetectable		 4y8wB-5j5dA:
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.
4Y8W_C_STRC603_1
(CYTOCHROME P450
21-HYDROXYLASE)		 5j5d 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
SYNTHASE
(Mycobacterium
tuberculosis) 		5 / 12 VAL A 244
ASP A 196
SER A 212
VAL A 298
LEU A  15
 None
 0.96A 4y8wC-5j5dA:
undetectable		 4y8wC-5j5dA:
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.
5G44_A_YTZA1512_1
(NUCLEAR RECEPTOR
ROR-GAMMA)		 5j5d 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
SYNTHASE
(Mycobacterium
tuberculosis) 		5 / 9 GLN A 267
LEU A 289
ALA A 218
VAL A 244
ALA A 250
 None
 1.13A 5g44A-5j5dA:
undetectable		 5g44A-5j5dA:
21.97
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.
5IMS_A_ACTA708_0
(ACETOLACTATE
SYNTHASE CATALYTIC
SUBUNIT,
MITOCHONDRIAL)		 5j5d 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
SYNTHASE
(Mycobacterium
tuberculosis) 		3 / 3 GLY A 255
GLY A 256
GLN A 278
 None
 0.46A 5imsA-5j5dA:
undetectable		 5imsA-5j5dA:
20.68
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.
5Y2T_A_8LXA501_0
(PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA)		 5j5d 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
SYNTHASE
(Mycobacterium
tuberculosis) 		5 / 12 LEU A 141
PHE A 210
GLY A 194
LEU A 177
LEU A 225
 None
None
6GT  A 403 (-4.2A)
None
None
 1.24A 5y2tA-5j5dA:
undetectable		 5y2tA-5j5dA:
undetectable
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.
6AWO_A_SREA701_1
(SODIUM-DEPENDENT
SEROTONIN
TRANSPORTER)		 5j5d 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
SYNTHASE
(Mycobacterium
tuberculosis) 		5 / 9 TYR A 191
ASP A 144
ALA A 162
GLY A 180
GLY A 169
 None
 1.28A 6awoA-5j5dA:
undetectable		 6awoA-5j5dA:
19.20
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.
6AWQ_A_SREA701_1
(SODIUM-DEPENDENT
SEROTONIN
TRANSPORTER)		 5j5d 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
SYNTHASE
(Mycobacterium
tuberculosis) 		5 / 9 TYR A 191
ASP A 144
ALA A 162
GLY A 180
GLY A 169
 None
 1.27A 6awqA-5j5dA:
undetectable		 6awqA-5j5dA:
19.20
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.
6EUQ_A_DXCA502_0
(MULTIDRUG
TRANSPORTER MDFA)		 5j5d 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
SYNTHASE
(Mycobacterium
tuberculosis) 		5 / 11 ASN A 199
ASP A 196
LEU A 203
GLY A 169
LEU A 226
 None
 1.37A 6euqA-5j5dA:
undetectable		 6euqA-5j5dA:
25.46