SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4hkt'

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.
1VQ1_B_SAMB301_0
(N5-GLUTAMINE
METHYLTRANSFERASE,
HEMK)		 4hkt INOSITOL
2-DEHYDROGENASE
(Sinorhizobium
meliloti) 		6 / 12 THR A  74
ILE A  57
GLY A   9
ILE A  68
VAL A  51
GLU A  50
 None
 1.44A 1vq1B-4hktA:
6.0		 1vq1B-4hktA:
22.41
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.
1ZQ9_B_SAMB4001_0
(PROBABLE
DIMETHYLADENOSINE
TRANSFERASE)		 4hkt INOSITOL
2-DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 12 GLY A 307
GLY A 304
LEU A 106
PRO A  94
PHE A  90
 None
GOL  A 413 (-3.6A)
None
None
None
 0.94A 1zq9B-4hktA:
5.8		 1zq9B-4hktA:
20.29
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.
2AJV_L_COCL501_1
(ANTIBODY 7A1 FAB')		 4hkt INOSITOL
2-DEHYDROGENASE
(Sinorhizobium
meliloti) 		4 / 7 ALA A 231
TYR A 233
ARG A 151
TYR A 279
 None
 1.19A 2ajvH-4hktA:
undetectable
2ajvL-4hktA:
undetectable		 2ajvH-4hktA:
19.05
2ajvL-4hktA:
19.63
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.
2FKE_A_FK5A108_1
(FK506 BINDING
PROTEIN)		 4hkt INOSITOL
2-DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 11 ASP A  77
VAL A  66
ILE A  89
HIS A  75
ILE A  95
 None
 1.41A 2fkeA-4hktA:
undetectable		 2fkeA-4hktA:
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.
2Q2H_B_ACTB501_0
(SECRETION CHAPERONE,
PHAGE-DISPLAY
DERIVED PEPTIDE)		 4hkt INOSITOL
2-DEHYDROGENASE
(Sinorhizobium
meliloti) 		3 / 3 ARG A 151
SER A 228
TYR A 233
 None
 0.98A 2q2hA-4hktA:
undetectable
2q2hB-4hktA:
undetectable		 2q2hA-4hktA:
17.82
2q2hB-4hktA:
17.82
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.
2ZJ0_C_2FAC500_2
(ADENOSYLHOMOCYSTEINA
SE)		 4hkt INOSITOL
2-DEHYDROGENASE
(Sinorhizobium
meliloti) 		4 / 5 LEU A 183
GLN A 216
THR A 217
THR A 147
 None
 1.35A 2zj0C-4hktA:
9.3		 2zj0C-4hktA:
24.20
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.
3DEU_B_SALB306_1
(TRANSCRIPTIONAL
REGULATOR SLYA)		 4hkt INOSITOL
2-DEHYDROGENASE
(Sinorhizobium
meliloti) 		4 / 6 THR A  74
ILE A  54
LEU A   8
THR A  70
 None
 0.81A 3deuB-4hktA:
undetectable		 3deuB-4hktA:
17.65
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.
4ACA_C_DXCC1476_0
(TRANSLATION
ELONGATION FACTOR
SELB)		 4hkt INOSITOL
2-DEHYDROGENASE
(Sinorhizobium
meliloti) 		4 / 5 ILE A 148
ALA A 179
HIS A 174
ARG A 123
 None
 1.30A 4acaB-4hktA:
6.7
4acaC-4hktA:
6.7		 4acaB-4hktA:
22.95
4acaC-4hktA:
22.95
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.
4DCM_A_SAMA401_0
(RIBOSOMAL RNA LARGE
SUBUNIT
METHYLTRANSFERASE G)		 4hkt INOSITOL
2-DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 11 ALA A  42
ASP A  34
GLY A   9
GLY A  11
GLU A  92
 None
 1.04A 4dcmA-4hktA:
6.6		 4dcmA-4hktA:
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.
4DX5_B_MIYB1103_1
(ACRIFLAVINE
RESISTANCE PROTEIN B)		 4hkt INOSITOL
2-DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 12 SER A 219
GLY A 243
SER A 244
ILE A 135
VAL A 131
 None
 0.99A 4dx5B-4hktA:
0.0		 4dx5B-4hktA:
15.96
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.
4DX5_B_MIYB1103_1
(ACRIFLAVINE
RESISTANCE PROTEIN B)		 4hkt INOSITOL
2-DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 12 SER A 219
SER A 244
ILE A 135
ALA A 134
VAL A 131
 None
 1.16A 4dx5B-4hktA:
0.0		 4dx5B-4hktA:
15.96
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.
4KCN_A_MTLA804_0
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4hkt INOSITOL
2-DEHYDROGENASE
(Sinorhizobium
meliloti) 		4 / 6 ARG A 254
GLU A 251
ARG A 238
ASP A 236
 None
 0.93A 4kcnA-4hktA:
undetectable		 4kcnA-4hktA:
21.00
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.
4KCN_B_MTLB805_0
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4hkt INOSITOL
2-DEHYDROGENASE
(Sinorhizobium
meliloti) 		4 / 6 ARG A 254
GLU A 251
ARG A 238
ASP A 236
 None
 0.95A 4kcnB-4hktA:
undetectable		 4kcnB-4hktA:
21.00
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.
4LNW_A_T3A502_1
(THYROID HORMONE
RECEPTOR ALPHA)		 4hkt INOSITOL
2-DEHYDROGENASE
(Sinorhizobium
meliloti) 		4 / 8 SER A 150
ASP A 175
GLN A 237
MET A 129
 None
None
None
EDO  A 407 (-4.7A)
 1.09A 4lnwA-4hktA:
undetectable		 4lnwA-4hktA:
20.67
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.
4M6T_A_SAMA201_0
(RNA POLYMERASE
II-ASSOCIATED FACTOR
1 HOMOLOG, LINKER,
RNA
POLYMERASE-ASSOCIATE
D PROTEIN LEO1)		 4hkt INOSITOL
2-DEHYDROGENASE
(Sinorhizobium
meliloti) 		4 / 4 ILE A  63
VAL A  32
VAL A  30
ARG A   4
 None
 1.15A 4m6tA-4hktA:
undetectable		 4m6tA-4hktA:
20.99
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.
4RET_C_DGXC2005_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)		 4hkt INOSITOL
2-DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 12 GLU A  92
LEU A 116
GLY A 307
PHE A 120
ARG A 122
 None
GOL  A 413 (-4.0A)
None
None
None
 1.27A 4retC-4hktA:
undetectable		 4retC-4hktA:
16.38
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.
4RN6_A_15UA301_1
(THROMBIN HEAVY CHAIN)		 4hkt INOSITOL
2-DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 10 TYR A 283
LEU A   7
ALA A  40
ALA A  18
GLY A  11
 None
 1.19A 4rn6A-4hktA:
undetectable		 4rn6A-4hktA:
19.37
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.
4U95_B_MIYB1102_1
(MULTIDRUG EFFLUX
PUMP SUBUNIT ACRB)		 4hkt INOSITOL
2-DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 12 SER A 219
GLY A 243
SER A 244
ILE A 135
VAL A 131
 None
 1.02A 4u95B-4hktA:
undetectable		 4u95B-4hktA:
16.29
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.
4U95_B_MIYB1102_1
(MULTIDRUG EFFLUX
PUMP SUBUNIT ACRB)		 4hkt INOSITOL
2-DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 12 SER A 219
SER A 244
ILE A 135
ALA A 134
VAL A 131
 None
 1.08A 4u95B-4hktA:
undetectable		 4u95B-4hktA:
16.29
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.
5HRQ_E_IPHE101_0
(INSULIN A-CHAIN
INSULIN B-CHAIN)		 4hkt INOSITOL
2-DEHYDROGENASE
(Sinorhizobium
meliloti) 		4 / 7 ILE A  68
CYH A  69
LEU A   7
ALA A  33
 None
 1.01A 5hrqE-4hktA:
undetectable
5hrqF-4hktA:
undetectable
5hrqJ-4hktA:
undetectable		 5hrqE-4hktA:
8.97
5hrqF-4hktA:
6.41
5hrqJ-4hktA:
6.41
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.
5VCE_A_RITA602_1
(CYTOCHROME P450 3A4)		 4hkt INOSITOL
2-DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 12 PHE A   5
PHE A 290
ILE A  89
THR A  70
ALA A  33
 None
 1.06A 5vceA-4hktA:
undetectable		 5vceA-4hktA:
21.88
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.
6AF6_A_GLYA507_0
(L-PROLYL-[PEPTIDYL-C
ARRIER PROTEIN]
DEHYDROGENASE)		 4hkt INOSITOL
2-DEHYDROGENASE
(Sinorhizobium
meliloti) 		3 / 3 TYR A 235
HIS A 174
MET A 171
 None
 1.16A 6af6A-4hktA:
undetectable		 6af6A-4hktA:
22.20