SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3t8i'

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.
1DMY_A_AZMA400_1
(MURINE CARBONIC
ANHYDRASE V)		 3t8i PURINE NUCLEOSIDASE,
(IUNH-2)
(Sulfolobus
solfataricus) 		5 / 11 VAL A   6
SER A  22
LEU A  27
LEU A  50
THR A  49
 None
 1.40A 1dmyA-3t8iA:
undetectable		 1dmyA-3t8iA:
21.17
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.
1HSH_C_MK1C402_1
(HIV-II PROTEASE)		 3t8i PURINE NUCLEOSIDASE,
(IUNH-2)
(Sulfolobus
solfataricus) 		5 / 12 GLY A 178
ILE A 118
ILE A 173
ILE A 146
ILE A 144
 None
 0.79A 1hshC-3t8iA:
undetectable		 1hshC-3t8iA:
17.32
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.
1MIC_A_DVAA6_0
(GRAMICIDIN A)		 3t8i PURINE NUCLEOSIDASE,
(IUNH-2)
(Sulfolobus
solfataricus) 		3 / 3 ALA A  11
VAL A 217
TRP A  87
 None
 0.90A 1micA-3t8iA:
undetectable
1micB-3t8iA:
undetectable		 1micA-3t8iA:
3.96
1micB-3t8iA:
3.96
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.
1RL8_A_RITA9001_1
(PROTEASE RETROPEPSIN)		 3t8i PURINE NUCLEOSIDASE,
(IUNH-2)
(Sulfolobus
solfataricus) 		6 / 12 ASP A 238
ALA A  17
VAL A   6
ILE A 244
ALA A 120
ILE A 121
 GOL  A 307 ( 2.6A)
None
None
None
None
CA  A 400 ( 4.8A)
 1.38A 1rl8A-3t8iA:
undetectable		 1rl8A-3t8iA:
16.18
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.
2QMZ_B_LDPB502_1
(RIBOSYLDIHYDRONICOTI
NAMIDE DEHYDROGENASE)		 3t8i PURINE NUCLEOSIDASE,
(IUNH-2)
(Sulfolobus
solfataricus) 		4 / 5 PHE A  48
PHE A 213
TRP A  87
GLY A  83
 None
 1.42A 2qmzA-3t8iA:
3.6
2qmzB-3t8iA:
3.6		 2qmzA-3t8iA:
22.01
2qmzB-3t8iA:
22.01
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.
3EKP_B_478B200_2
(PROTEASE)		 3t8i PURINE NUCLEOSIDASE,
(IUNH-2)
(Sulfolobus
solfataricus) 		6 / 10 ASP A 238
ALA A  17
VAL A   6
ILE A 244
ALA A 120
ILE A 121
 GOL  A 307 ( 2.6A)
None
None
None
None
CA  A 400 ( 4.8A)
 1.41A 3ekpB-3t8iA:
undetectable		 3ekpB-3t8iA:
15.86
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.
3EKT_B_017B200_2
(PROTEASE)		 3t8i PURINE NUCLEOSIDASE,
(IUNH-2)
(Sulfolobus
solfataricus) 		6 / 9 ASP A 238
ALA A  17
VAL A   6
ILE A 244
ALA A 120
ILE A 121
 GOL  A 307 ( 2.6A)
None
None
None
None
CA  A 400 ( 4.8A)
 1.36A 3ektB-3t8iA:
undetectable		 3ektB-3t8iA:
15.86
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.
3EQM_A_ASDA601_1
(CYTOCHROME P450 19A1)		 3t8i PURINE NUCLEOSIDASE,
(IUNH-2)
(Sulfolobus
solfataricus) 		5 / 10 ILE A 121
ASP A  14
THR A  15
VAL A 217
LEU A 221
 CA  A 400 ( 4.8A)
CA  A 400 (-2.3A)
None
None
None
 1.36A 3eqmA-3t8iA:
undetectable		 3eqmA-3t8iA:
20.58
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.
3L2V_A_RLTA397_1
(INTEGRASE)		 3t8i PURINE NUCLEOSIDASE,
(IUNH-2)
(Sulfolobus
solfataricus) 		4 / 7 ASP A   9
ASP A  14
GLN A  41
GLU A  42
 CA  A 400 (-3.1A)
CA  A 400 (-2.3A)
None
None
 1.18A 3l2vA-3t8iA:
undetectable		 3l2vA-3t8iA:
20.62
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.
3N23_A_OBNA1_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)		 3t8i PURINE NUCLEOSIDASE,
(IUNH-2)
(Sulfolobus
solfataricus) 		5 / 11 ASP A   7
ASN A 126
ALA A 171
PHE A 162
ILE A 146
 None
None
None
GOL  A 310 (-4.6A)
None
 1.42A 3n23A-3t8iA:
4.5		 3n23A-3t8iA:
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.
3N2O_C_AG2C1002_1
(BIOSYNTHETIC
ARGININE
DECARBOXYLASE)		 3t8i PURINE NUCLEOSIDASE,
(IUNH-2)
(Sulfolobus
solfataricus) 		4 / 8 HIS A 100
SER A  64
ASP A 167
ASP A   7
 None
 1.21A 3n2oC-3t8iA:
undetectable
3n2oD-3t8iA:
undetectable		 3n2oC-3t8iA:
20.03
3n2oD-3t8iA:
20.03
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.
3RAE_H_LFXH101_1
(DNA TOPOISOMERASE 4
SUBUNIT A
DNA TOPOISOMERASE 4
SUBUNIT B)		 3t8i PURINE NUCLEOSIDASE,
(IUNH-2)
(Sulfolobus
solfataricus) 		4 / 5 SER A 239
GLY A 233
GLU A 201
GLU A 197
 None
 1.49A 3raeB-3t8iA:
undetectable
3raeD-3t8iA:
1.3		 3raeB-3t8iA:
21.58
3raeD-3t8iA:
22.09
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.
3S7S_A_EXMA601_1
(CYTOCHROME P450 19A1)		 3t8i PURINE NUCLEOSIDASE,
(IUNH-2)
(Sulfolobus
solfataricus) 		5 / 9 ALA A  17
ASP A  14
THR A  15
VAL A 217
LEU A 221
 None
CA  A 400 (-2.3A)
None
None
None
 1.46A 3s7sA-3t8iA:
0.0		 3s7sA-3t8iA:
20.58
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.
3U7S_A_017A202_1
(POL POLYPROTEIN)		 3t8i PURINE NUCLEOSIDASE,
(IUNH-2)
(Sulfolobus
solfataricus) 		5 / 9 ALA A 104
ASP A 103
GLY A  63
ILE A  32
PRO A  96
 None
 1.12A 3u7sA-3t8iA:
undetectable		 3u7sA-3t8iA:
13.62
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.
4FGJ_A_1PQA304_0
(RIBOSYLDIHYDRONICOTI
NAMIDE DEHYDROGENASE
[QUINONE])		 3t8i PURINE NUCLEOSIDASE,
(IUNH-2)
(Sulfolobus
solfataricus) 		5 / 8 ILE A  18
PHE A 213
TRP A  87
GLY A  83
ASN A 218
 None
 1.43A 4fgjA-3t8iA:
3.7
4fgjB-3t8iA:
3.1		 4fgjA-3t8iA:
22.26
4fgjB-3t8iA:
22.26
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.
4KCN_A_ACTA803_0
(NITRIC OXIDE
SYNTHASE, BRAIN)		 3t8i PURINE NUCLEOSIDASE,
(IUNH-2)
(Sulfolobus
solfataricus) 		4 / 6 GLY A 233
ILE A 235
GLN A 229
SER A 194
 None
 0.92A 4kcnA-3t8iA:
undetectable		 4kcnA-3t8iA:
22.14
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.
4KQ8_A_ASDA602_1
(CYTOCHROME P450 19A1)		 3t8i PURINE NUCLEOSIDASE,
(IUNH-2)
(Sulfolobus
solfataricus) 		5 / 10 ALA A  17
ASP A  14
THR A  15
VAL A 217
LEU A 221
 None
CA  A 400 (-2.3A)
None
None
None
 1.44A 4kq8A-3t8iA:
undetectable		 4kq8A-3t8iA:
18.92
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.
4KQ8_A_ASDA602_1
(CYTOCHROME P450 19A1)		 3t8i PURINE NUCLEOSIDASE,
(IUNH-2)
(Sulfolobus
solfataricus) 		5 / 10 ILE A 121
ASP A  14
THR A  15
VAL A 217
LEU A 221
 CA  A 400 ( 4.8A)
CA  A 400 (-2.3A)
None
None
None
 1.36A 4kq8A-3t8iA:
undetectable		 4kq8A-3t8iA:
18.92
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.
4OBW_C_SAMC601_0
(2-METHOXY-6-POLYPREN
YL-1,4-BENZOQUINOL
METHYLASE,
MITOCHONDRIAL)		 3t8i PURINE NUCLEOSIDASE,
(IUNH-2)
(Sulfolobus
solfataricus) 		5 / 12 ASN A 126
GLY A  35
ASP A 167
GLY A  83
SER A 122
 None
 0.99A 4obwC-3t8iA:
3.6		 4obwC-3t8iA:
21.09
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.
4PBH_A_BEZA401_0
(TRAP DICARBOXYLATE
TRANSPORTER, DCTP
SUBUNIT, PUTATIVE)		 3t8i PURINE NUCLEOSIDASE,
(IUNH-2)
(Sulfolobus
solfataricus) 		5 / 12 ILE A 244
THR A 241
THR A 182
ARG A   2
LEU A 119
 None
 1.03A 4pbhA-3t8iA:
undetectable		 4pbhA-3t8iA:
23.06
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.
4RYA_A_MTLA501_1
(ABC TRANSPORTER
SUBSTRATE BINDING
PROTEIN (SORBITOL))		 3t8i PURINE NUCLEOSIDASE,
(IUNH-2)
(Sulfolobus
solfataricus) 		3 / 3 GLU A 111
TYR A  61
GLU A  99
 None
 0.78A 4ryaA-3t8iA:
0.7		 4ryaA-3t8iA:
20.91
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.
4ZVM_B_DM2B303_1
(RIBOSYLDIHYDRONICOTI
NAMIDE DEHYDROGENASE
[QUINONE])		 3t8i PURINE NUCLEOSIDASE,
(IUNH-2)
(Sulfolobus
solfataricus) 		5 / 11 PHE A  48
PHE A 213
TRP A  87
GLY A  83
ASN A 218
 None
 1.45A 4zvmA-3t8iA:
3.7
4zvmB-3t8iA:
4.0		 4zvmA-3t8iA:
22.01
4zvmB-3t8iA:
22.01
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.
5HW4_A_SAMA801_0
(RIBOSOMAL RNA SMALL
SUBUNIT
METHYLTRANSFERASE I)		 3t8i PURINE NUCLEOSIDASE,
(IUNH-2)
(Sulfolobus
solfataricus) 		5 / 12 ILE A 102
THR A 125
ASP A   7
ALA A 130
VAL A 137
 None
 1.21A 5hw4A-3t8iA:
undetectable		 5hw4A-3t8iA:
24.68
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.
5JKW_A_TESA601_1
(AROMATASE)		 3t8i PURINE NUCLEOSIDASE,
(IUNH-2)
(Sulfolobus
solfataricus) 		5 / 11 ILE A 121
ASP A  14
THR A  15
VAL A 217
LEU A 221
 CA  A 400 ( 4.8A)
CA  A 400 (-2.3A)
None
None
None
 1.39A 5jkwA-3t8iA:
undetectable		 5jkwA-3t8iA:
20.58
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.
5JL6_A_ASDA601_1
(AROMATASE)		 3t8i PURINE NUCLEOSIDASE,
(IUNH-2)
(Sulfolobus
solfataricus) 		5 / 9 ILE A 121
ASP A  14
THR A  15
VAL A 217
LEU A 221
 CA  A 400 ( 4.8A)
CA  A 400 (-2.3A)
None
None
None
 1.40A 5jl6A-3t8iA:
0.0		 5jl6A-3t8iA:
20.58
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.
5JL7_A_ASDA601_1
(AROMATASE)		 3t8i PURINE NUCLEOSIDASE,
(IUNH-2)
(Sulfolobus
solfataricus) 		5 / 10 ILE A 121
ASP A  14
THR A  15
VAL A 217
LEU A 221
 CA  A 400 ( 4.8A)
CA  A 400 (-2.3A)
None
None
None
 1.40A 5jl7A-3t8iA:
undetectable		 5jl7A-3t8iA:
20.58
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.
5JL9_A_ASDA601_1
(AROMATASE)		 3t8i PURINE NUCLEOSIDASE,
(IUNH-2)
(Sulfolobus
solfataricus) 		5 / 9 ILE A 121
ASP A  14
THR A  15
VAL A 217
LEU A 221
 CA  A 400 ( 4.8A)
CA  A 400 (-2.3A)
None
None
None
 1.39A 5jl9A-3t8iA:
0.0		 5jl9A-3t8iA:
20.58
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.
5MSD_A_BEZA1202_0
(CARBOXYLIC ACID
REDUCTASE)		 3t8i PURINE NUCLEOSIDASE,
(IUNH-2)
(Sulfolobus
solfataricus) 		4 / 5 ILE A 235
PHE A 296
SER A 239
ALA A 189
 None
 1.24A 5msdA-3t8iA:
undetectable		 5msdA-3t8iA:
13.53
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.
5MUG_A_VIVA301_1
(ALPHA-TOCOPHEROL
TRANSFER PROTEIN)		 3t8i PURINE NUCLEOSIDASE,
(IUNH-2)
(Sulfolobus
solfataricus) 		3 / 3 SER A 239
SER A 243
PHE A 214
 None
 0.93A 5mugA-3t8iA:
undetectable		 5mugA-3t8iA:
22.12
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.
5WWS_B_SAMB501_0
(PUTATIVE
METHYLTRANSFERASE
NSUN6)		 3t8i PURINE NUCLEOSIDASE,
(IUNH-2)
(Sulfolobus
solfataricus) 		6 / 12 PRO A 123
GLY A  35
ASP A   7
ILE A 127
GLY A  29
ASP A  14
 None
None
None
None
None
CA  A 400 (-2.3A)
 1.37A 5wwsB-3t8iA:
2.4		 5wwsB-3t8iA:
22.18