SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3qbd'

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.
1C9S_J_TRPJ81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN)		 3qbd 3-DEHYDROQUINATE
SYNTHASE
(Mycobacterium
tuberculosis) 		4 / 8 GLY A  94
ALA A  41
HIS A  38
ILE A  93
 None
 0.78A 1c9sI-3qbdA:
undetectable
1c9sJ-3qbdA:
undetectable		 1c9sI-3qbdA:
14.20
1c9sJ-3qbdA:
14.20
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.
1C9S_U_TRPU81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN)		 3qbd 3-DEHYDROQUINATE
SYNTHASE
(Mycobacterium
tuberculosis) 		4 / 8 GLY A  94
ALA A  41
HIS A  38
ILE A  93
 None
 0.80A 1c9sU-3qbdA:
undetectable
1c9sV-3qbdA:
undetectable		 1c9sU-3qbdA:
14.20
1c9sV-3qbdA:
14.20
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.
1DB1_A_VDXA428_2
(VITAMIN D NUCLEAR
RECEPTOR)		 3qbd 3-DEHYDROQUINATE
SYNTHASE
(Mycobacterium
tuberculosis) 		4 / 6 LEU A 217
ILE A 297
ARG A 293
VAL A 187
 None
 0.97A 1db1A-3qbdA:
undetectable		 1db1A-3qbdA:
21.95
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.
1FBM_B_RTLB951_0
(PROTEIN (CARTILAGE
OLIGOMERIC MATRIX
PROTEIN))		 3qbd 3-DEHYDROQUINATE
SYNTHASE
(Mycobacterium
tuberculosis) 		4 / 4 THR A 171
LEU A 172
LEU A 210
GLN A 207
 NAD  A 400 (-4.9A)
None
None
None
 1.22A 1fbmA-3qbdA:
undetectable		 1fbmA-3qbdA:
8.86
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.
1GTN_B_TRPB81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN)		 3qbd 3-DEHYDROQUINATE
SYNTHASE
(Mycobacterium
tuberculosis) 		4 / 8 GLY A  94
ALA A  41
HIS A  38
ILE A  93
 None
 0.77A 1gtnA-3qbdA:
undetectable
1gtnB-3qbdA:
undetectable		 1gtnA-3qbdA:
14.20
1gtnB-3qbdA:
14.20
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.
1GTN_D_TRPD81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN)		 3qbd 3-DEHYDROQUINATE
SYNTHASE
(Mycobacterium
tuberculosis) 		4 / 7 VAL A  82
GLY A  84
THR A 119
ILE A  86
 None
 0.86A 1gtnC-3qbdA:
undetectable
1gtnD-3qbdA:
undetectable		 1gtnC-3qbdA:
14.20
1gtnD-3qbdA:
14.20
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.
1MAA_B_DMEB996_1
(ACETYLCHOLINESTERASE)		 3qbd 3-DEHYDROQUINATE
SYNTHASE
(Mycobacterium
tuberculosis) 		4 / 6 TYR A 247
GLU A 278
ILE A 297
GLY A 191
 None
 1.06A 1maaB-3qbdA:
undetectable
1maaD-3qbdA:
undetectable		 1maaB-3qbdA:
22.46
1maaD-3qbdA:
22.46
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.
1UTD_B_TRPB81_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 3qbd 3-DEHYDROQUINATE
SYNTHASE
(Mycobacterium
tuberculosis) 		4 / 8 GLY A  94
ALA A  41
HIS A  38
ILE A  93
 None
 0.79A 1utdB-3qbdA:
undetectable
1utdC-3qbdA:
undetectable		 1utdB-3qbdA:
14.20
1utdC-3qbdA:
14.20
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.
1UTD_F_TRPF81_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 3qbd 3-DEHYDROQUINATE
SYNTHASE
(Mycobacterium
tuberculosis) 		4 / 8 GLY A  94
ALA A  41
HIS A  38
ILE A  93
 None
 0.80A 1utdF-3qbdA:
undetectable
1utdG-3qbdA:
undetectable		 1utdF-3qbdA:
14.20
1utdG-3qbdA:
14.20
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.
1UTD_I_TRPI81_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 3qbd 3-DEHYDROQUINATE
SYNTHASE
(Mycobacterium
tuberculosis) 		4 / 8 GLY A  94
ALA A  41
HIS A  38
ILE A  93
 None
 0.77A 1utdI-3qbdA:
undetectable
1utdJ-3qbdA:
undetectable		 1utdI-3qbdA:
14.20
1utdJ-3qbdA:
14.20
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.
1UTD_J_TRPJ81_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 3qbd 3-DEHYDROQUINATE
SYNTHASE
(Mycobacterium
tuberculosis) 		4 / 8 GLY A  94
ALA A  41
HIS A  38
ILE A  93
 None
 0.77A 1utdJ-3qbdA:
undetectable
1utdK-3qbdA:
undetectable		 1utdJ-3qbdA:
14.20
1utdK-3qbdA:
14.20
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.
2ADM_A_SAMA500_0
(ADENINE-N6-DNA-METHY
LTRANSFERASE TAQI)		 3qbd 3-DEHYDROQUINATE
SYNTHASE
(Mycobacterium
tuberculosis) 		5 / 11 GLU A 256
ALA A 267
ILE A 181
ALA A 185
ASP A 178
 None
 1.34A 2admA-3qbdA:
2.1		 2admA-3qbdA:
23.85
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.
2OIP_C_MTXC613_1
(CHAIN A, CRYSTAL
STRUCTURE OF DHFR)		 3qbd 3-DEHYDROQUINATE
SYNTHASE
(Mycobacterium
tuberculosis) 		5 / 12 ALA A 170
ASP A 168
LEU A  26
ARG A  58
THR A 171
 None
None
None
None
NAD  A 400 (-4.9A)
 1.09A 2oipC-3qbdA:
undetectable		 2oipC-3qbdA:
21.30
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.
2QAK_A_1UNA1001_1
(PROTEASE RETROPEPSIN)		 3qbd 3-DEHYDROQUINATE
SYNTHASE
(Mycobacterium
tuberculosis) 		6 / 12 LEU A  48
GLY A 106
ALA A 109
ASP A 111
VAL A  43
GLY A  77
 None
NAD  A 400 (-3.1A)
None
NAD  A 400 (-3.1A)
None
None
 1.33A 2qakA-3qbdA:
undetectable		 2qakA-3qbdA:
15.73
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.
2UXP_B_CLMB1211_0
(HTH-TYPE
TRANSCRIPTIONAL
REGULATOR TTGR)		 3qbd 3-DEHYDROQUINATE
SYNTHASE
(Mycobacterium
tuberculosis) 		5 / 11 HIS A 128
ALA A 108
VAL A  43
GLY A 146
ILE A 147
 None
NAD  A 400 (-3.3A)
None
None
None
 1.29A 2uxpB-3qbdA:
undetectable		 2uxpB-3qbdA:
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.
3BVB_B_017B401_2
(PROTEASE
(RETROPEPSIN))		 3qbd 3-DEHYDROQUINATE
SYNTHASE
(Mycobacterium
tuberculosis) 		6 / 12 LEU A  48
GLY A 106
ALA A 109
ASP A 111
VAL A  43
GLY A  77
 None
NAD  A 400 (-3.1A)
None
NAD  A 400 (-3.1A)
None
None
 1.35A 3bvbB-3qbdA:
undetectable		 3bvbB-3qbdA:
16.56
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.
3CFQ_A_DIFA1_1
(TRANSTHYRETIN)		 3qbd 3-DEHYDROQUINATE
SYNTHASE
(Mycobacterium
tuberculosis) 		4 / 6 LEU A  48
ALA A 109
LEU A 104
THR A 110
 None
 0.94A 3cfqA-3qbdA:
undetectable		 3cfqA-3qbdA:
17.31
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.
3EKT_B_017B200_1
(PROTEASE)		 3qbd 3-DEHYDROQUINATE
SYNTHASE
(Mycobacterium
tuberculosis) 		6 / 9 LEU A  48
GLY A 106
ALA A 109
ASP A 111
VAL A  43
GLY A  77
 None
NAD  A 400 (-3.1A)
None
NAD  A 400 (-3.1A)
None
None
 1.35A 3ektA-3qbdA:
undetectable		 3ektA-3qbdA:
16.51
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.
3OXW_B_017B200_1
(HIV-1 PROTEASE)		 3qbd 3-DEHYDROQUINATE
SYNTHASE
(Mycobacterium
tuberculosis) 		6 / 10 LEU A  48
GLY A 106
ALA A 109
ASP A 111
VAL A  43
GLY A  77
 None
NAD  A 400 (-3.1A)
None
NAD  A 400 (-3.1A)
None
None
 1.34A 3oxwA-3qbdA:
undetectable		 3oxwA-3qbdA:
15.60
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.
3OY4_B_017B200_2
(HIV-1 PROTEASE)		 3qbd 3-DEHYDROQUINATE
SYNTHASE
(Mycobacterium
tuberculosis) 		6 / 10 LEU A  48
GLY A 106
ALA A 109
ASP A 111
VAL A  43
GLY A  77
 None
NAD  A 400 (-3.1A)
None
NAD  A 400 (-3.1A)
None
None
 1.33A 3oy4B-3qbdA:
undetectable		 3oy4B-3qbdA:
16.06
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.
3UVV_B_9CRB501_1
(RETINOIC ACID
RECEPTOR RXR-ALPHA)		 3qbd 3-DEHYDROQUINATE
SYNTHASE
(Mycobacterium
tuberculosis) 		5 / 12 ALA A  49
ALA A  52
LEU A 104
VAL A  89
ILE A  86
 None
 1.10A 3uvvB-3qbdA:
undetectable		 3uvvB-3qbdA:
23.50
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.
4DQB_B_017B101_2
(ASPARTYL PROTEASE)		 3qbd 3-DEHYDROQUINATE
SYNTHASE
(Mycobacterium
tuberculosis) 		6 / 10 LEU A  48
GLY A 106
ALA A 109
ASP A 111
VAL A  43
GLY A  77
 None
NAD  A 400 (-3.1A)
None
NAD  A 400 (-3.1A)
None
None
 1.32A 4dqbB-3qbdA:
undetectable		 4dqbB-3qbdA:
16.87
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.
4DQC_A_017A101_2
(ASPARTYL PROTEASE)		 3qbd 3-DEHYDROQUINATE
SYNTHASE
(Mycobacterium
tuberculosis) 		6 / 9 LEU A  48
GLY A 106
ALA A 109
ASP A 111
VAL A  43
GLY A  77
 None
NAD  A 400 (-3.1A)
None
NAD  A 400 (-3.1A)
None
None
 1.33A 4dqcB-3qbdA:
undetectable		 4dqcB-3qbdA:
16.26
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.
4DQE_B_017B101_2
(ASPARTYL PROTEASE)		 3qbd 3-DEHYDROQUINATE
SYNTHASE
(Mycobacterium
tuberculosis) 		6 / 10 LEU A  48
GLY A 106
ALA A 109
ASP A 111
VAL A  43
GLY A  77
 None
NAD  A 400 (-3.1A)
None
NAD  A 400 (-3.1A)
None
None
 1.33A 4dqeB-3qbdA:
undetectable		 4dqeB-3qbdA:
16.26
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.
4DQH_B_017B101_2
(WILD-TYPE HIV-1
PROTEASE DIMER)		 3qbd 3-DEHYDROQUINATE
SYNTHASE
(Mycobacterium
tuberculosis) 		6 / 10 LEU A  48
GLY A 106
ALA A 109
ASP A 111
VAL A  43
GLY A  77
 None
NAD  A 400 (-3.1A)
None
NAD  A 400 (-3.1A)
None
None
 1.33A 4dqhB-3qbdA:
undetectable		 4dqhB-3qbdA:
15.95
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.
4I13_A_FOLA201_1
(DIHYDROFOLATE
REDUCTASE)		 3qbd 3-DEHYDROQUINATE
SYNTHASE
(Mycobacterium
tuberculosis) 		3 / 3 ASP A 168
ARG A  58
THR A 171
 None
None
NAD  A 400 (-4.9A)
 0.82A 4i13A-3qbdA:
undetectable		 4i13A-3qbdA:
21.07
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.
4KY8_E_MTXE603_1
(BIFUNCTIONAL
THYMIDYLATE
SYNTHASE-DIHYDROFOLA
TE REDUCTASE)		 3qbd 3-DEHYDROQUINATE
SYNTHASE
(Mycobacterium
tuberculosis) 		5 / 12 ALA A 170
ASP A 168
LEU A  26
ARG A  58
THR A 171
 None
None
None
None
NAD  A 400 (-4.9A)
 1.12A 4ky8E-3qbdA:
undetectable		 4ky8E-3qbdA:
21.43
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)		 3qbd 3-DEHYDROQUINATE
SYNTHASE
(Mycobacterium
tuberculosis) 		5 / 12 MET A 184
LEU A 301
VAL A 216
LEU A 220
ALA A 204
 None
 1.33A 4m11A-3qbdA:
undetectable		 4m11A-3qbdA:
21.52
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.
4MK4_B_CHDB504_0
(FERROCHELATASE,
MITOCHONDRIAL)		 3qbd 3-DEHYDROQUINATE
SYNTHASE
(Mycobacterium
tuberculosis) 		3 / 3 LEU A 251
ILE A 255
ARG A 258
 None
 0.71A 4mk4B-3qbdA:
2.8		 4mk4B-3qbdA:
21.79
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.
4P3R_A_FOLA201_1
(DIHYDROFOLATE
REDUCTASE)		 3qbd 3-DEHYDROQUINATE
SYNTHASE
(Mycobacterium
tuberculosis) 		3 / 3 ASP A 168
ARG A  58
THR A 171
 None
None
NAD  A 400 (-4.9A)
 0.80A 4p3rA-3qbdA:
2.1		 4p3rA-3qbdA:
21.07
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.
4PO0_A_NPSA601_1
(SERUM ALBUMIN)		 3qbd 3-DEHYDROQUINATE
SYNTHASE
(Mycobacterium
tuberculosis) 		5 / 12 VAL A  64
LEU A  27
ARG A  58
VAL A  40
ARG A  56
 None
 1.33A 4po0A-3qbdA:
undetectable		 4po0A-3qbdA:
21.22
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.
4Q0D_A_MTXA604_1
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 3qbd 3-DEHYDROQUINATE
SYNTHASE
(Mycobacterium
tuberculosis) 		5 / 12 ALA A 170
ASP A 168
LEU A  26
ARG A  58
THR A 171
 None
None
None
None
NAD  A 400 (-4.9A)
 1.16A 4q0dA-3qbdA:
2.2		 4q0dA-3qbdA:
21.43
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.
4Q0D_B_MTXB604_1
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 3qbd 3-DEHYDROQUINATE
SYNTHASE
(Mycobacterium
tuberculosis) 		5 / 12 ALA A 170
ASP A 168
LEU A  26
ARG A  58
THR A 171
 None
None
None
None
NAD  A 400 (-4.9A)
 1.15A 4q0dB-3qbdA:
2.2		 4q0dB-3qbdA:
21.43
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.
4Q0D_C_MTXC604_1
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 3qbd 3-DEHYDROQUINATE
SYNTHASE
(Mycobacterium
tuberculosis) 		5 / 12 ALA A 170
ASP A 168
LEU A  26
ARG A  58
THR A 171
 None
None
None
None
NAD  A 400 (-4.9A)
 1.16A 4q0dC-3qbdA:
2.3		 4q0dC-3qbdA:
21.43
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.
4Q0D_D_MTXD604_1
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 3qbd 3-DEHYDROQUINATE
SYNTHASE
(Mycobacterium
tuberculosis) 		5 / 12 ALA A 170
ASP A 168
LEU A  26
ARG A  58
THR A 171
 None
None
None
None
NAD  A 400 (-4.9A)
 1.16A 4q0dD-3qbdA:
2.3		 4q0dD-3qbdA:
21.43
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.
4Q0D_E_MTXE604_1
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 3qbd 3-DEHYDROQUINATE
SYNTHASE
(Mycobacterium
tuberculosis) 		5 / 12 ALA A 170
ASP A 168
LEU A  26
ARG A  58
THR A 171
 None
None
None
None
NAD  A 400 (-4.9A)
 1.15A 4q0dE-3qbdA:
2.3		 4q0dE-3qbdA:
21.43
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.
5BOJ_A_4TXA201_1
(TRANSTHYRETIN)		 3qbd 3-DEHYDROQUINATE
SYNTHASE
(Mycobacterium
tuberculosis) 		4 / 6 LEU A  48
ALA A 109
LEU A 104
THR A 110
 None
 0.96A 5bojA-3qbdA:
undetectable		 5bojA-3qbdA:
18.08
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.
5C0O_H_SAMH301_1
(TRNA
(ADENINE(58)-N(1))-M
ETHYLTRANSFERASE
TRMI)		 3qbd 3-DEHYDROQUINATE
SYNTHASE
(Mycobacterium
tuberculosis) 		4 / 5 THR A 110
GLY A 106
HIS A 265
ASP A 111
 None
NAD  A 400 (-3.1A)
None
NAD  A 400 (-3.1A)
 1.25A 5c0oH-3qbdA:
5.1		 5c0oH-3qbdA:
23.91
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.
5EB3_A_UEGA202_1
(YFIR)		 3qbd 3-DEHYDROQUINATE
SYNTHASE
(Mycobacterium
tuberculosis) 		4 / 4 LEU A 335
ILE A 193
PRO A 196
LEU A 199
 None
 1.24A 5eb3A-3qbdA:
4.3		 5eb3A-3qbdA:
17.93
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.
5ECN_D_LEUD602_0
(JASMONIC ACID-AMIDO
SYNTHETASE JAR1)		 3qbd 3-DEHYDROQUINATE
SYNTHASE
(Mycobacterium
tuberculosis) 		4 / 8 ILE A 126
ALA A  41
VAL A  43
VAL A 124
 None
 0.87A 5ecnD-3qbdA:
2.3		 5ecnD-3qbdA:
21.69
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.
5ESL_A_1YNA701_2
(LANOSTEROL 14-ALPHA
DEMETHYLASE)		 3qbd 3-DEHYDROQUINATE
SYNTHASE
(Mycobacterium
tuberculosis) 		4 / 5 ALA A 170
PRO A 130
GLY A 146
LEU A 134
 None
None
None
NAD  A 400 (-4.0A)
 0.99A 5eslA-3qbdA:
undetectable		 5eslA-3qbdA:
21.06
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.
5EYP_B_LOCB502_2
(TUBULIN BETA CHAIN)		 3qbd 3-DEHYDROQUINATE
SYNTHASE
(Mycobacterium
tuberculosis) 		5 / 12 LEU A 101
ALA A 117
ILE A  69
ALA A  41
ILE A  71
 None
 1.30A 5eypB-3qbdA:
3.5		 5eypB-3qbdA:
21.26
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.
5IKQ_A_JMSA602_2
(PROSTAGLANDIN G/H
SYNTHASE 2)		 3qbd 3-DEHYDROQUINATE
SYNTHASE
(Mycobacterium
tuberculosis) 		3 / 3 VAL A 274
SER A 299
MET A 184
 None
 0.93A 5ikqA-3qbdA:
undetectable		 5ikqA-3qbdA:
22.24
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.
5TT3_H_EZLH303_1
(ALPHA-CARBONIC
ANHYDRASE)		 3qbd 3-DEHYDROQUINATE
SYNTHASE
(Mycobacterium
tuberculosis) 		4 / 8 HIS A  67
VAL A  42
LEU A  59
ALA A  60
 None
 0.88A 5tt3H-3qbdA:
undetectable		 5tt3H-3qbdA:
21.81
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.
5TUI_B_CTCB405_0
(TETRACYCLINE
DESTRUCTASE TET(50))		 3qbd 3-DEHYDROQUINATE
SYNTHASE
(Mycobacterium
tuberculosis) 		5 / 12 GLY A 123
GLY A  84
PHE A  85
VAL A  89
ILE A  69
 None
 1.41A 5tuiB-3qbdA:
undetectable		 5tuiB-3qbdA:
22.45
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.
6PAH_A_DAHA600_1
(PHENYLALANINE
4-MONOOXYGENASE)		 3qbd 3-DEHYDROQUINATE
SYNTHASE
(Mycobacterium
tuberculosis) 		4 / 6 LEU A 303
HIS A 265
HIS A 249
GLU A 186
 None
 1.00A 6pahA-3qbdA:
undetectable		 6pahA-3qbdA:
21.47