SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '668'


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.
1FMO_E_ADNE351_1
(CAMP-DEPENDENT
PROTEIN KINASE)		 3mtl CELL DIVISION
PROTEIN KINASE 16
(Homo
sapiens) 		7 / 12 LEU A 171
GLY A 172
VAL A 179
ALA A 192
VAL A 224
ASN A 291
LEU A 293
 FEF  A 668 ( 3.8A)
FEF  A 668 ( 4.2A)
FEF  A 668 (-4.9A)
FEF  A 668 (-3.3A)
FEF  A 668 (-4.7A)
FEF  A 668 (-3.9A)
FEF  A 668 (-4.2A)
 0.68A 1fmoE-3mtlA:
23.8		 1fmoE-3mtlA:
27.84
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.
1MUO_A_ADNA1_1
(AURORA-RELATED
KINASE 1)		 3mtl CELL DIVISION
PROTEIN KINASE 16
(Homo
sapiens) 		6 / 9 LEU A 171
GLY A 172
VAL A 179
ALA A 192
TYR A 242
LEU A 293
 FEF  A 668 ( 3.8A)
FEF  A 668 ( 4.2A)
FEF  A 668 (-4.9A)
FEF  A 668 (-3.3A)
FEF  A 668 (-4.7A)
FEF  A 668 (-4.2A)
 0.76A 1muoA-3mtlA:
10.4		 1muoA-3mtlA:
27.48
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.
1ND4_A_KANA1300_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E)		 5hjp OXYSTEROLS RECEPTOR
LXR-BETA
(Homo
sapiens) 		5 / 10 ASP B 245
ARG B 473
ARG B 241
ASP B 284
GLU B 281
 None
None
None
None
668  B 501 (-3.4A)
 1.46A 1nd4A-5hjpB:
undetectable		 1nd4A-5hjpB:
25.25
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.
2EIK_J_CHDJ60_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE
VIIA-HEART
CYTOCHROME C OXIDASE
SUBUNIT 1)		 5hjp OXYSTEROLS RECEPTOR
LXR-BETA
(Homo
sapiens) 		4 / 7 LEU B 345
PHE B 340
ARG B 319
LEU B 313
 668  B 501 (-3.5A)
None
668  B 501 (-3.6A)
None
 1.11A 2eikA-5hjpB:
undetectable
2eikJ-5hjpB:
undetectable		 2eikA-5hjpB:
18.22
2eikJ-5hjpB:
12.60
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2EUF_B_LQQB401_1
(CELL DIVISION
PROTEIN KINASE 6)		 3mtl CELL DIVISION
PROTEIN KINASE 16
(Homo
sapiens) 		8 / 12 VAL A 179
LYS A 194
VAL A 224
PHE A 240
ASP A 246
ASN A 291
LEU A 293
ALA A 303
 FEF  A 668 (-4.9A)
None
FEF  A 668 (-4.7A)
FEF  A 668 ( 4.3A)
FEF  A 668 ( 4.3A)
FEF  A 668 (-3.9A)
FEF  A 668 (-4.2A)
FEF  A 668 ( 4.0A)
 0.76A 2eufB-3mtlA:
29.6		 2eufB-3mtlA:
40.42
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.
2FUM_C_MIXC2539_1
(PROBABLE
SERINE/THREONINE-PRO
TEIN KINASE PKNB)		 3mtl CELL DIVISION
PROTEIN KINASE 16
(Homo
sapiens) 		6 / 12 LEU A 171
GLY A 172
VAL A 179
ALA A 192
TYR A 242
ASN A 291
 FEF  A 668 ( 3.8A)
FEF  A 668 ( 4.2A)
FEF  A 668 (-4.9A)
FEF  A 668 (-3.3A)
FEF  A 668 (-4.7A)
FEF  A 668 (-3.9A)
 0.61A 2fumC-3mtlA:
23.0		 2fumC-3mtlA:
24.38
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.
2FUM_D_MIXD3539_1
(PROBABLE
SERINE/THREONINE-PRO
TEIN KINASE PKNB)		 3mtl CELL DIVISION
PROTEIN KINASE 16
(Homo
sapiens) 		7 / 12 LEU A 171
GLY A 172
GLY A 174
VAL A 179
ALA A 192
LYS A 288
ASN A 291
 FEF  A 668 ( 3.8A)
FEF  A 668 ( 4.2A)
None
FEF  A 668 (-4.9A)
FEF  A 668 (-3.3A)
FEF  A 668 ( 4.9A)
FEF  A 668 (-3.9A)
 0.76A 2fumD-3mtlA:
15.8		 2fumD-3mtlA:
24.38
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.
3BUF_A_AEGA394_0
(BETA-SECRETASE 1)		 3ggg PREPHENATE
DEHYDROGENASE
(Aquifex
aeolicus) 		4 / 5 ASP D  62
ILE D  58
ILE D  68
GLY D  37
 NAD  D6686 (-2.9A)
None
None
NAD  D6686 (-3.4A)
 0.88A 3bufA-3gggD:
undetectable		 3bufA-3gggD:
21.45
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.
3CS9_B_NILB600_2
(PROTO-ONCOGENE
TYROSINE-PROTEIN
KINASE ABL1)		 3mtl CELL DIVISION
PROTEIN KINASE 16
(Homo
sapiens) 		5 / 9 LEU A 171
VAL A 179
LYS A 194
VAL A 224
LEU A 293
 FEF  A 668 ( 3.8A)
FEF  A 668 (-4.9A)
None
FEF  A 668 (-4.7A)
FEF  A 668 (-4.2A)
 0.85A 3cs9B-3mtlA:
15.2		 3cs9B-3mtlA:
28.00
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.
3CS9_D_NILD600_2
(PROTO-ONCOGENE
TYROSINE-PROTEIN
KINASE ABL1)		 3mtl CELL DIVISION
PROTEIN KINASE 16
(Homo
sapiens) 		4 / 6 LEU A 171
VAL A 179
LYS A 194
LEU A 293
 FEF  A 668 ( 3.8A)
FEF  A 668 (-4.9A)
None
FEF  A 668 (-4.2A)
 0.82A 3cs9D-3mtlA:
20.3		 3cs9D-3mtlA:
28.00
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.
3CZH_A_D2VA602_1
(CYTOCHROME P450 2R1)		 3mtl CELL DIVISION
PROTEIN KINASE 16
(Homo
sapiens) 		5 / 12 PHE A 240
ALA A 177
ALA A 303
VAL A 224
ILE A 209
 FEF  A 668 ( 4.3A)
None
FEF  A 668 ( 4.0A)
FEF  A 668 (-4.7A)
None
 1.13A 3czhA-3mtlA:
undetectable		 3czhA-3mtlA:
21.82
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.
3FUP_B_MI1B1_1
(TYROSINE-PROTEIN
KINASE JAK2)		 3mtl CELL DIVISION
PROTEIN KINASE 16
(Homo
sapiens) 		9 / 12 LEU A 171
GLY A 172
GLY A 174
VAL A 179
ALA A 192
VAL A 224
TYR A 242
LEU A 243
LEU A 293
 FEF  A 668 ( 3.8A)
FEF  A 668 ( 4.2A)
None
FEF  A 668 (-4.9A)
FEF  A 668 (-3.3A)
FEF  A 668 (-4.7A)
FEF  A 668 (-4.7A)
FEF  A 668 (-4.3A)
FEF  A 668 (-4.2A)
 0.60A 3fupB-3mtlA:
22.3		 3fupB-3mtlA:
26.35
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.
3FUP_B_MI1B1_1
(TYROSINE-PROTEIN
KINASE JAK2)		 3mtl CELL DIVISION
PROTEIN KINASE 16
(Homo
sapiens) 		8 / 12 LEU A 171
VAL A 179
ALA A 192
LYS A 194
VAL A 224
TYR A 242
LEU A 243
LEU A 293
 FEF  A 668 ( 3.8A)
FEF  A 668 (-4.9A)
FEF  A 668 (-3.3A)
None
FEF  A 668 (-4.7A)
FEF  A 668 (-4.7A)
FEF  A 668 (-4.3A)
FEF  A 668 (-4.2A)
 0.75A 3fupB-3mtlA:
22.3		 3fupB-3mtlA:
26.35
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.
3G0E_A_B49A9000_1
(MAST/STEM CELL
GROWTH FACTOR
RECEPTOR)		 3mtl CELL DIVISION
PROTEIN KINASE 16
(Homo
sapiens) 		6 / 11 LEU A 171
VAL A 179
ALA A 192
VAL A 224
TYR A 242
LEU A 293
 FEF  A 668 ( 3.8A)
FEF  A 668 (-4.9A)
FEF  A 668 (-3.3A)
FEF  A 668 (-4.7A)
FEF  A 668 (-4.7A)
FEF  A 668 (-4.2A)
 0.50A 3g0eA-3mtlA:
20.4		 3g0eA-3mtlA:
24.62
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.
3G0F_A_B49A9001_1
(MAST/STEM CELL
GROWTH FACTOR
RECEPTOR)		 3mtl CELL DIVISION
PROTEIN KINASE 16
(Homo
sapiens) 		6 / 11 LEU A 171
VAL A 179
ALA A 192
TYR A 242
ASP A 246
LEU A 293
 FEF  A 668 ( 3.8A)
FEF  A 668 (-4.9A)
FEF  A 668 (-3.3A)
FEF  A 668 (-4.7A)
FEF  A 668 ( 4.3A)
FEF  A 668 (-4.2A)
 0.72A 3g0fA-3mtlA:
21.0		 3g0fA-3mtlA:
24.62
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.
3LXK_A_MI1A1125_1
(TYROSINE-PROTEIN
KINASE JAK3)		 3mtl CELL DIVISION
PROTEIN KINASE 16
(Homo
sapiens) 		9 / 12 LEU A 171
GLY A 172
VAL A 179
ALA A 192
LYS A 194
VAL A 224
TYR A 242
LEU A 293
ALA A 303
 FEF  A 668 ( 3.8A)
FEF  A 668 ( 4.2A)
FEF  A 668 (-4.9A)
FEF  A 668 (-3.3A)
None
FEF  A 668 (-4.7A)
FEF  A 668 (-4.7A)
FEF  A 668 (-4.2A)
FEF  A 668 ( 4.0A)
 0.98A 3lxkA-3mtlA:
22.8		 3lxkA-3mtlA:
27.32
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.
3SFU_A_RBVA601_1
(RNA POLYMERASE)		 4mtp RNA DEPENDENT RNA
POLYMERASE
(Japanese
encephalitis
virus) 		5 / 9 ASP A 541
ASN A 613
GLY A 667
ASP A 668
ASP A 669
 ASP  A 541 ( 0.6A)
ASN  A 613 ( 0.6A)
GLY  A 667 ( 0.0A)
ASP  A 668 ( 0.6A)
ASP  A 669 ( 0.6A)
 1.06A 3sfuA-4mtpA:
19.2		 3sfuA-4mtpA:
22.02
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.
3SFU_A_RBVA601_1
(RNA POLYMERASE)		 4mtp RNA DEPENDENT RNA
POLYMERASE
(Japanese
encephalitis
virus) 		5 / 9 ASP A 541
SER A 604
ASN A 613
GLY A 667
ASP A 668
 ASP  A 541 ( 0.6A)
SER  A 604 ( 0.0A)
ASN  A 613 ( 0.6A)
GLY  A 667 ( 0.0A)
ASP  A 668 ( 0.6A)
 1.04A 3sfuA-4mtpA:
19.2		 3sfuA-4mtpA:
22.02
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.
3SFU_B_RBVB601_1
(RNA POLYMERASE)		 4mtp RNA DEPENDENT RNA
POLYMERASE
(Japanese
encephalitis
virus) 		5 / 9 ASP A 541
ASN A 613
GLY A 667
ASP A 668
ASP A 669
 ASP  A 541 ( 0.6A)
ASN  A 613 ( 0.6A)
GLY  A 667 ( 0.0A)
ASP  A 668 ( 0.6A)
ASP  A 669 ( 0.6A)
 1.01A 3sfuB-4mtpA:
21.6		 3sfuB-4mtpA:
22.02
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.
3SFU_C_RBVC601_1
(RNA POLYMERASE)		 4mtp RNA DEPENDENT RNA
POLYMERASE
(Japanese
encephalitis
virus) 		5 / 11 ASP A 541
SER A 604
ASN A 613
GLY A 667
ASP A 668
 ASP  A 541 ( 0.6A)
SER  A 604 ( 0.0A)
ASN  A 613 ( 0.6A)
GLY  A 667 ( 0.0A)
ASP  A 668 ( 0.6A)
 1.04A 3sfuC-4mtpA:
19.6		 3sfuC-4mtpA:
22.02
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3TI1_A_B49A299_1
(CYCLIN-DEPENDENT
KINASE 2)		 3mtl CELL DIVISION
PROTEIN KINASE 16
(Homo
sapiens) 		5 / 9 ALA A 192
VAL A 224
PHE A 240
ASP A 246
LEU A 293
 FEF  A 668 (-3.3A)
FEF  A 668 (-4.7A)
FEF  A 668 ( 4.3A)
FEF  A 668 ( 4.3A)
FEF  A 668 (-4.2A)
 0.69A 3ti1A-3mtlA:
31.2		 3ti1A-3mtlA:
51.72
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.
3U52_A_CUA515_0
(PHENOL HYDROXYLASE
COMPONENT PHL
PHENOL HYDROXYLASE
COMPONENT PHN)		 3ggg PREPHENATE
DEHYDROGENASE
(Aquifex
aeolicus) 		3 / 3 HIS D 147
HIS D 205
ILE D 171
 NAD  D6686 ( 4.9A)
None
None
 0.83A 3u52A-3gggD:
undetectable
3u52C-3gggD:
undetectable		 3u52A-3gggD:
20.58
3u52C-3gggD:
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.
4CKI_A_ADNA2022_1
(PROTO-ONCOGENE
TYROSINE-PROTEIN
KINASE RECEPTOR RET)		 3mtl CELL DIVISION
PROTEIN KINASE 16
(Homo
sapiens) 		6 / 11 LEU A 171
GLY A 172
VAL A 179
ALA A 192
TYR A 242
LEU A 293
 FEF  A 668 ( 3.8A)
FEF  A 668 ( 4.2A)
FEF  A 668 (-4.9A)
FEF  A 668 (-3.3A)
FEF  A 668 (-4.7A)
FEF  A 668 (-4.2A)
 0.54A 4ckiA-3mtlA:
22.4		 4ckiA-3mtlA:
24.53
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.
4CKJ_A_ADNA2014_1
(PROTO-ONCOGENE
TYROSINE-PROTEIN
KINASE RECEPTOR RET)		 3mtl CELL DIVISION
PROTEIN KINASE 16
(Homo
sapiens) 		7 / 10 LEU A 171
GLY A 172
GLY A 174
VAL A 179
ALA A 192
TYR A 242
LEU A 293
 FEF  A 668 ( 3.8A)
FEF  A 668 ( 4.2A)
None
FEF  A 668 (-4.9A)
FEF  A 668 (-3.3A)
FEF  A 668 (-4.7A)
FEF  A 668 (-4.2A)
 0.64A 4ckjA-3mtlA:
22.4		 4ckjA-3mtlA:
24.53
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.
4H2F_A_ADNA601_1
(5'-NUCLEOTIDASE)		 3i08 NEUROGENIC LOCUS
NOTCH HOMOLOG
PROTEIN 1
(Homo
sapiens) 		5 / 9 ASN A1485
GLY A1477
GLY A1478
GLY A1474
ASP A1486
 None
None
None
None
CL  A1668 (-4.5A)
 1.48A 4h2fA-3i08A:
undetectable		 4h2fA-3i08A:
18.26
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.
4L9I_A_8PRA601_1
(RHODOPSIN KINASE)		 3mtl CELL DIVISION
PROTEIN KINASE 16
(Homo
sapiens) 		4 / 7 VAL A 179
ALA A 192
ASP A 246
LEU A 293
 FEF  A 668 (-4.9A)
FEF  A 668 (-3.3A)
FEF  A 668 ( 4.3A)
FEF  A 668 (-4.2A)
 0.79A 4l9iA-3mtlA:
7.5		 4l9iA-3mtlA:
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.
4O0W_A_ADNA501_1
(AURORA KINASE A)		 3mtl CELL DIVISION
PROTEIN KINASE 16
(Homo
sapiens) 		5 / 6 LEU A 171
GLY A 172
VAL A 179
ALA A 192
LEU A 293
 FEF  A 668 ( 3.8A)
FEF  A 668 ( 4.2A)
FEF  A 668 (-4.9A)
FEF  A 668 (-3.3A)
FEF  A 668 (-4.2A)
 0.62A 4o0wA-3mtlA:
18.5		 4o0wA-3mtlA:
27.51
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4OGR_A_ADNA401_1
(CYCLIN-DEPENDENT
KINASE 9)		 3mtl CELL DIVISION
PROTEIN KINASE 16
(Homo
sapiens) 		5 / 8 VAL A 179
ALA A 192
ASP A 246
ASN A 291
LEU A 293
 FEF  A 668 (-4.9A)
FEF  A 668 (-3.3A)
FEF  A 668 ( 4.3A)
FEF  A 668 (-3.9A)
FEF  A 668 (-4.2A)
 0.53A 4ogrA-3mtlA:
30.4		 4ogrA-3mtlA:
38.22
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4OGR_E_ADNE401_1
(CYCLIN-DEPENDENT
KINASE 9)		 3mtl CELL DIVISION
PROTEIN KINASE 16
(Homo
sapiens) 		5 / 7 GLY A 172
ALA A 192
ASP A 246
ASN A 291
LEU A 293
 FEF  A 668 ( 4.2A)
FEF  A 668 (-3.3A)
FEF  A 668 ( 4.3A)
FEF  A 668 (-3.9A)
FEF  A 668 (-4.2A)
 0.48A 4ogrE-3mtlA:
23.8		 4ogrE-3mtlA:
38.22
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.
4OTI_A_MI1A1001_1
(SERINE/THREONINE-PRO
TEIN KINASE N1)		 3mtl CELL DIVISION
PROTEIN KINASE 16
(Homo
sapiens) 		8 / 12 LEU A 171
GLY A 172
GLY A 174
VAL A 179
ALA A 192
LYS A 194
VAL A 224
ALA A 303
 FEF  A 668 ( 3.8A)
FEF  A 668 ( 4.2A)
None
FEF  A 668 (-4.9A)
FEF  A 668 (-3.3A)
None
FEF  A 668 (-4.7A)
FEF  A 668 ( 4.0A)
 0.71A 4otiA-3mtlA:
15.6		 4otiA-3mtlA:
26.42
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.
4OTI_A_MI1A1001_1
(SERINE/THREONINE-PRO
TEIN KINASE N1)		 3mtl CELL DIVISION
PROTEIN KINASE 16
(Homo
sapiens) 		8 / 12 LEU A 171
GLY A 172
VAL A 179
ALA A 192
LYS A 194
VAL A 224
LEU A 293
ALA A 303
 FEF  A 668 ( 3.8A)
FEF  A 668 ( 4.2A)
FEF  A 668 (-4.9A)
FEF  A 668 (-3.3A)
None
FEF  A 668 (-4.7A)
FEF  A 668 (-4.2A)
FEF  A 668 ( 4.0A)
 0.64A 4otiA-3mtlA:
15.6		 4otiA-3mtlA:
26.42
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.
4QMZ_A_B49A401_1
(SERINE/THREONINE-PRO
TEIN KINASE 24)		 3mtl CELL DIVISION
PROTEIN KINASE 16
(Homo
sapiens) 		6 / 12 GLY A 172
VAL A 179
ALA A 192
TYR A 242
LEU A 243
LEU A 293
 FEF  A 668 ( 4.2A)
FEF  A 668 (-4.9A)
FEF  A 668 (-3.3A)
FEF  A 668 (-4.7A)
FEF  A 668 (-4.3A)
FEF  A 668 (-4.2A)
 0.61A 4qmzA-3mtlA:
23.5		 4qmzA-3mtlA:
28.89
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.
4RTM_A_SAMA301_0
(DNA ADENINE
METHYLASE)		 3ggg PREPHENATE
DEHYDROGENASE
(Aquifex
aeolicus) 		5 / 12 GLY D  42
GLY D  43
ALA D  71
ILE D  63
ASN D  64
 None
None
None
NAD  D6686 (-4.0A)
None
 1.04A 4rtmA-3gggD:
4.1		 4rtmA-3gggD:
25.30
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.
4RTP_A_SAMA301_0
(DNA ADENINE
METHYLASE)		 3ggg PREPHENATE
DEHYDROGENASE
(Aquifex
aeolicus) 		5 / 12 GLY D  39
SER D  44
ILE D  63
ASN D  64
PRO D 100
 NAD  D6686 (-3.3A)
None
NAD  D6686 (-4.0A)
None
NAD  D6686 (-4.6A)
 1.14A 4rtpA-3gggD:
4.9		 4rtpA-3gggD:
25.30
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.
4RTS_A_SAMA301_0
(DNA ADENINE
METHYLASE)		 3ggg PREPHENATE
DEHYDROGENASE
(Aquifex
aeolicus) 		5 / 12 GLY D  39
ASP D  62
ILE D  63
ASN D  64
PRO D 100
 NAD  D6686 (-3.3A)
NAD  D6686 (-2.9A)
NAD  D6686 (-4.0A)
None
NAD  D6686 (-4.6A)
 0.95A 4rtsA-3gggD:
undetectable		 4rtsA-3gggD:
25.30
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.
4UCK_A_SAMA2409_0
(RNA-DIRECTED RNA
POLYMERASE L)		 5hjp OXYSTEROLS RECEPTOR
LXR-BETA
(Homo
sapiens) 		6 / 12 GLU B 455
GLY B 464
GLY B 466
SER B 454
LEU B 449
THR B 272
 None
None
None
None
668  B 501 (-4.9A)
668  B 501 (-4.5A)
 1.42A 4uckA-5hjpB:
undetectable		 4uckA-5hjpB:
19.68
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.
4WH5_A_3QBA204_1
(LINCOSAMIDE
RESISTANCE PROTEIN)		 4mtp RNA DEPENDENT RNA
POLYMERASE
(Japanese
encephalitis
virus) 		5 / 12 GLY A 667
ASP A 668
ILE A 665
ALA A 664
HIS A 803
 GLY  A 667 ( 0.0A)
ASP  A 668 ( 0.6A)
ILE  A 665 ( 0.7A)
ALA  A 664 ( 0.0A)
HIS  A 803 ( 1.0A)
 1.28A 4wh5A-4mtpA:
undetectable		 4wh5A-4mtpA:
13.87
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.
5KPC_A_SAMA401_1
(PAVINE
N-METHYLTRANSFERASE)		 2zws NEUTRAL CERAMIDASE
(Pseudomonas
aeruginosa) 		4 / 5 PHE A 187
SER A 186
GLN A 142
ASP A   2
 None
GOL  A 668 ( 4.9A)
None
None
 1.50A 5kpcA-2zwsA:
undetectable		 5kpcA-2zwsA:
19.36
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5L2I_A_LQQA900_1
(CYCLIN-DEPENDENT
KINASE 6)		 3mtl CELL DIVISION
PROTEIN KINASE 16
(Homo
sapiens) 		8 / 12 GLY A 172
VAL A 179
ALA A 192
VAL A 224
PHE A 240
ASP A 246
LEU A 293
ALA A 303
 FEF  A 668 ( 4.2A)
FEF  A 668 (-4.9A)
FEF  A 668 (-3.3A)
FEF  A 668 (-4.7A)
FEF  A 668 ( 4.3A)
FEF  A 668 ( 4.3A)
FEF  A 668 (-4.2A)
FEF  A 668 ( 4.0A)
 0.56A 5l2iA-3mtlA:
18.0		 5l2iA-3mtlA:
39.60
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5L2T_A_6ZZA900_1
(CYCLIN-DEPENDENT
KINASE 6)		 3mtl CELL DIVISION
PROTEIN KINASE 16
(Homo
sapiens) 		7 / 12 GLY A 172
VAL A 179
ALA A 192
VAL A 224
PHE A 240
ASP A 246
LEU A 293
 FEF  A 668 ( 4.2A)
FEF  A 668 (-4.9A)
FEF  A 668 (-3.3A)
FEF  A 668 (-4.7A)
FEF  A 668 ( 4.3A)
FEF  A 668 ( 4.3A)
FEF  A 668 (-4.2A)
 0.85A 5l2tA-3mtlA:
18.2		 5l2tA-3mtlA:
39.60
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5L2T_A_6ZZA900_1
(CYCLIN-DEPENDENT
KINASE 6)		 3mtl CELL DIVISION
PROTEIN KINASE 16
(Homo
sapiens) 		7 / 12 VAL A 179
ALA A 192
VAL A 224
PHE A 240
ASP A 246
LEU A 293
ALA A 303
 FEF  A 668 (-4.9A)
FEF  A 668 (-3.3A)
FEF  A 668 (-4.7A)
FEF  A 668 ( 4.3A)
FEF  A 668 ( 4.3A)
FEF  A 668 (-4.2A)
FEF  A 668 ( 4.0A)
 0.87A 5l2tA-3mtlA:
18.2		 5l2tA-3mtlA:
39.60
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.
5LVN_A_ADNA402_1
(3-PHOSPHOINOSITIDE-D
EPENDENT PROTEIN
KINASE 1)		 3mtl CELL DIVISION
PROTEIN KINASE 16
(Homo
sapiens) 		7 / 11 LEU A 171
GLY A 172
VAL A 179
ALA A 192
VAL A 224
TYR A 242
LEU A 293
 FEF  A 668 ( 3.8A)
FEF  A 668 ( 4.2A)
FEF  A 668 (-4.9A)
FEF  A 668 (-3.3A)
FEF  A 668 (-4.7A)
FEF  A 668 (-4.7A)
FEF  A 668 (-4.2A)
 0.62A 5lvnA-3mtlA:
24.9		 5lvnA-3mtlA:
27.30
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.
5N3H_A_NCAA401_0
(CAMP-DEPENDENT
PROTEIN KINASE
CATALYTIC SUBUNIT
ALPHA)		 3mtl CELL DIVISION
PROTEIN KINASE 16
(Homo
sapiens) 		6 / 10 LEU A 171
VAL A 179
ALA A 192
VAL A 224
TYR A 242
LEU A 293
 FEF  A 668 ( 3.8A)
FEF  A 668 (-4.9A)
FEF  A 668 (-3.3A)
FEF  A 668 (-4.7A)
FEF  A 668 (-4.7A)
FEF  A 668 (-4.2A)
 0.64A 5n3hA-3mtlA:
24.0		 5n3hA-3mtlA:
27.00
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.
5TE8_C_08JC602_1
(CYTOCHROME P450 3A4)		 3ggg PREPHENATE
DEHYDROGENASE
(Aquifex
aeolicus) 		4 / 7 SER D  99
LEU D  97
ILE D 138
LEU D 139
 NAD  D6686 (-4.7A)
None
None
None
 0.93A 5te8C-3gggD:
undetectable		 5te8C-3gggD:
22.93
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.
5VCV_A_1N1A404_1
(MEMBRANE-ASSOCIATED
TYROSINE- AND
THREONINE-SPECIFIC
CDC2-INHIBITORY
KINASE)		 3mtl CELL DIVISION
PROTEIN KINASE 16
(Homo
sapiens) 		6 / 12 LEU A 171
ALA A 192
LYS A 194
GLU A 211
VAL A 224
LEU A 238
 FEF  A 668 ( 3.8A)
FEF  A 668 (-3.3A)
None
None
FEF  A 668 (-4.7A)
None
 1.00A 5vcvA-3mtlA:
22.5		 5vcvA-3mtlA:
23.87
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.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)		 3mtl CELL DIVISION
PROTEIN KINASE 16
(Homo
sapiens) 		5 / 12 LEU A 171
GLY A 172
VAL A 179
ALA A 192
PHE A 240
 FEF  A 668 ( 3.8A)
FEF  A 668 ( 4.2A)
FEF  A 668 (-4.9A)
FEF  A 668 (-3.3A)
FEF  A 668 ( 4.3A)
 0.43A 5xv7A-3mtlA:
15.5		 5xv7A-3mtlA:
13.68
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.
6A7P_A_9SCA601_1
(SERUM ALBUMIN)		 3wqy ALANINE--TRNA LIGASE
(Archaeoglobus
fulgidus) 		4 / 5 ASN A 359
VAL A 618
LEU A 614
SER A 724
 U  C1670 ( 3.9A)
None
None
A  C1668 ( 4.7A)
 1.24A 6a7pA-3wqyA:
2.7		 6a7pA-3wqyA:
22.73