SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '2ie8'

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.
1GX9_A_REAA1163_1
(BETA-LACTOGLOBULIN)		 2ie8 PHOSPHOGLYCERATE
KINASE
(Thermus
caldophilus) 		5 / 11 LEU A 259
VAL A 257
ILE A 202
GLU A 251
VAL A 195
 None
 1.39A 1gx9A-2ie8A:
undetectable		 1gx9A-2ie8A:
16.54
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.
1HK3_A_T44A3002_1
(SERUM ALBUMIN)		 2ie8 PHOSPHOGLYCERATE
KINASE
(Thermus
caldophilus) 		4 / 8 LEU A  46
ARG A  43
LEU A  54
SER A  38
 None
 0.88A 1hk3A-2ie8A:
undetectable		 1hk3A-2ie8A:
22.17
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.
1MJQ_B_SAMB200_0
(METHIONINE REPRESSOR)		 2ie8 PHOSPHOGLYCERATE
KINASE
(Thermus
caldophilus) 		5 / 11 GLU A  75
GLY A  74
GLU A  99
LEU A 103
GLU A 107
 None
 1.37A 1mjqA-2ie8A:
undetectable
1mjqB-2ie8A:
undetectable		 1mjqA-2ie8A:
15.12
1mjqB-2ie8A:
15.12
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.
1WG8_B_SAMB3141_0
(PREDICTED
S-ADENOSYLMETHIONINE
-DEPENDENT
METHYLTRANSFERASE)		 2ie8 PHOSPHOGLYCERATE
KINASE
(Thermus
caldophilus) 		5 / 12 GLY A 346
GLY A 347
GLY A 314
PHE A 342
SER A 373
 None
 1.17A 1wg8B-2ie8A:
4.5		 1wg8B-2ie8A:
25.42
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.
1YAJ_C_BEZC5013_0
(CES1 PROTEIN)		 2ie8 PHOSPHOGLYCERATE
KINASE
(Thermus
caldophilus) 		5 / 8 GLY A 348
GLY A 347
GLY A 346
SER A 350
LEU A 374
 None
 1.02A 1yajC-2ie8A:
undetectable		 1yajC-2ie8A:
21.39
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.
2AB2_A_SNLA502_2
(MINERALOCORTICOID
RECEPTOR)		 2ie8 PHOSPHOGLYCERATE
KINASE
(Thermus
caldophilus) 		4 / 6 LEU A 103
LEU A  54
LEU A 111
LEU A  15
 None
 1.01A 2ab2A-2ie8A:
undetectable		 2ab2A-2ie8A:
20.20
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.
2OA1_B_ADNB2005_1
(TRYPTOPHAN
HALOGENASE)		 2ie8 PHOSPHOGLYCERATE
KINASE
(Thermus
caldophilus) 		4 / 7 GLY A 370
GLY A 371
VAL A 351
ARG A  34
 None
 0.79A 2oa1B-2ie8A:
undetectable		 2oa1B-2ie8A:
22.84
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.
2OIP_C_MTXC613_1
(CHAIN A, CRYSTAL
STRUCTURE OF DHFR)		 2ie8 PHOSPHOGLYCERATE
KINASE
(Thermus
caldophilus) 		5 / 12 VAL A 195
ALA A 217
LEU A 223
PHE A 222
LEU A 247
 None
 1.15A 2oipC-2ie8A:
undetectable		 2oipC-2ie8A:
19.23
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.
2OKC_A_SAMA500_0
(TYPE I RESTRICTION
ENZYME STYSJI M
PROTEIN)		 2ie8 PHOSPHOGLYCERATE
KINASE
(Thermus
caldophilus) 		5 / 12 ILE A 292
ALA A 334
GLY A 332
GLY A 327
VAL A 354
 None
 1.11A 2okcA-2ie8A:
2.1		 2okcA-2ie8A:
22.37
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.
2OKC_B_SAMB500_0
(TYPE I RESTRICTION
ENZYME STYSJI M
PROTEIN)		 2ie8 PHOSPHOGLYCERATE
KINASE
(Thermus
caldophilus) 		5 / 12 ILE A 292
ALA A 334
GLY A 332
GLY A 327
VAL A 354
 None
 1.15A 2okcB-2ie8A:
undetectable		 2okcB-2ie8A:
22.37
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.
2OXT_A_SAMA300_0
(NUCLEOSIDE-2'-O-METH
YLTRANSFERASE)		 2ie8 PHOSPHOGLYCERATE
KINASE
(Thermus
caldophilus) 		5 / 12 GLY A 293
GLY A 289
ILE A 269
ASP A 291
VAL A 318
 None
 0.86A 2oxtA-2ie8A:
2.6		 2oxtA-2ie8A:
22.57
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.
2QD5_A_CHDA702_0
(FERROCHELATASE)		 2ie8 PHOSPHOGLYCERATE
KINASE
(Thermus
caldophilus) 		3 / 3 LEU A 160
PRO A 161
ARG A  13
 None
 0.60A 2qd5A-2ie8A:
undetectable		 2qd5A-2ie8A:
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.
2XFS_A_J01A500_1
(ORF12)		 2ie8 PHOSPHOGLYCERATE
KINASE
(Thermus
caldophilus) 		4 / 8 LEU A 206
ARG A 249
GLY A 248
ALA A 250
 None
 0.89A 2xfsA-2ie8A:
undetectable		 2xfsA-2ie8A:
23.92
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.
2XH9_A_J01A1436_1
(ORF12)		 2ie8 PHOSPHOGLYCERATE
KINASE
(Thermus
caldophilus) 		4 / 8 LEU A 206
ARG A 249
GLY A 248
ALA A 250
 None
 0.89A 2xh9A-2ie8A:
undetectable		 2xh9A-2ie8A:
24.12
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.
2ZIF_B_SAMB298_1
(PUTATIVE
MODIFICATION
METHYLASE)		 2ie8 PHOSPHOGLYCERATE
KINASE
(Thermus
caldophilus) 		3 / 3 ASP A 197
THR A 381
GLU A 378
 None
 0.80A 2zifB-2ie8A:
3.0		 2zifB-2ie8A:
25.13
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.
3HJ3_C_MTXC613_1
(CHAIN A, CRYSTAL
STRUCTURE OF DHFR)		 2ie8 PHOSPHOGLYCERATE
KINASE
(Thermus
caldophilus) 		5 / 12 VAL A 195
ALA A 217
LEU A 223
PHE A 222
LEU A 247
 None
 1.16A 3hj3C-2ie8A:
undetectable		 3hj3C-2ie8A:
20.38
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.
3JQ7_C_DX2C270_1
(PTERIDINE REDUCTASE
1)		 2ie8 PHOSPHOGLYCERATE
KINASE
(Thermus
caldophilus) 		4 / 8 SER A  38
TYR A  20
VAL A  53
LEU A  15
 None
 1.03A 3jq7C-2ie8A:
5.5		 3jq7C-2ie8A:
22.22
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.
3JWQ_A_VIAA901_1
(CGMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE
CATALYTIC DOMAIN,
CONE CGMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE
SUBUNIT ALPHA
CHIMERA)		 2ie8 PHOSPHOGLYCERATE
KINASE
(Thermus
caldophilus) 		5 / 9 LEU A 175
VAL A 201
LEU A 212
PHE A 311
VAL A 344
 None
 0.91A 3jwqA-2ie8A:
undetectable		 3jwqA-2ie8A:
23.75
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.
3KO0_P_TFPP201_1
(PROTEIN S100-A4)		 2ie8 PHOSPHOGLYCERATE
KINASE
(Thermus
caldophilus) 		4 / 7 GLY A 347
GLY A 191
PHE A 376
PHE A 143
 None
 0.76A 3ko0M-2ie8A:
0.0
3ko0P-2ie8A:
undetectable		 3ko0M-2ie8A:
11.79
3ko0P-2ie8A:
11.79
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.
3KU1_H_SAMH226_0
(SAM-DEPENDENT
METHYLTRANSFERASE)		 2ie8 PHOSPHOGLYCERATE
KINASE
(Thermus
caldophilus) 		5 / 12 GLY A 191
VAL A 189
VAL A 188
ALA A 217
ILE A 292
 None
 1.04A 3ku1H-2ie8A:
undetectable		 3ku1H-2ie8A:
22.70
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.
3P5N_A_RBFA190_1
(RIBOFLAVIN UPTAKE
PROTEIN)		 2ie8 PHOSPHOGLYCERATE
KINASE
(Thermus
caldophilus) 		5 / 12 THR A 296
ASP A 291
GLY A 327
ALA A 330
ALA A 334
 None
 0.77A 3p5nA-2ie8A:
undetectable		 3p5nA-2ie8A:
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.
3P5N_B_RBFB190_1
(RIBOFLAVIN UPTAKE
PROTEIN)		 2ie8 PHOSPHOGLYCERATE
KINASE
(Thermus
caldophilus) 		5 / 12 THR A 296
ASP A 291
GLY A 327
ALA A 330
ALA A 334
 None
 0.77A 3p5nB-2ie8A:
undetectable		 3p5nB-2ie8A:
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.
3RAE_F_LFXF101_1
(DNA TOPOISOMERASE 4
SUBUNIT A
DNA TOPOISOMERASE 4
SUBUNIT B)		 2ie8 PHOSPHOGLYCERATE
KINASE
(Thermus
caldophilus) 		3 / 4 SER A 128
GLY A 384
GLU A 375
 None
 0.69A 3raeA-2ie8A:
undetectable
3raeC-2ie8A:
undetectable		 3raeA-2ie8A:
22.60
3raeC-2ie8A:
20.82
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.
3UJ7_A_SAMA301_1
(PHOSPHOETHANOLAMINE
N-METHYLTRANSFERASE)		 2ie8 PHOSPHOGLYCERATE
KINASE
(Thermus
caldophilus) 		3 / 3 SER A 350
ASP A 291
ASP A 262
 None
 0.76A 3uj7A-2ie8A:
3.0		 3uj7A-2ie8A:
18.09
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.
3W1W_A_CHDA1503_0
(FERROCHELATASE,
MITOCHONDRIAL)		 2ie8 PHOSPHOGLYCERATE
KINASE
(Thermus
caldophilus) 		4 / 8 ILE A 214
LEU A 212
VAL A 201
GLY A 200
 None
 0.83A 3w1wA-2ie8A:
3.0		 3w1wA-2ie8A:
23.00
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.
3ZTV_A_ADNA1600_1
(NAD NUCLEOTIDASE)		 2ie8 PHOSPHOGLYCERATE
KINASE
(Thermus
caldophilus) 		5 / 9 GLY A 347
GLY A 348
ASN A 355
SER A 373
GLY A 370
 None
 1.16A 3ztvA-2ie8A:
undetectable		 3ztvA-2ie8A:
22.58
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.
4CCQ_A_ACTA1317_0
(THIOREDOXIN
REDUCTASE)		 2ie8 PHOSPHOGLYCERATE
KINASE
(Thermus
caldophilus) 		3 / 3 LEU A  58
GLU A 112
SER A  56
 None
 0.74A 4ccqA-2ie8A:
3.0		 4ccqA-2ie8A:
21.74
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.
4MWZ_A_SAMA301_1
(PHOSPHOETHANOLAMINE
N-METHYLTRANSFERASE,
PUTATIVE)		 2ie8 PHOSPHOGLYCERATE
KINASE
(Thermus
caldophilus) 		3 / 3 SER A 350
ASP A 291
ASP A 262
 None
 0.83A 4mwzA-2ie8A:
3.2		 4mwzA-2ie8A:
19.80
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4O33_A_TZNA501_1
(PHOSPHOGLYCERATE
KINASE 1)		 2ie8 PHOSPHOGLYCERATE
KINASE
(Thermus
caldophilus) 		8 / 12 GLY A 192
ALA A 193
GLY A 216
PHE A 220
MET A 288
LEU A 290
GLY A 317
VAL A 318
 None
 0.48A 4o33A-2ie8A:
51.1		 4o33A-2ie8A:
42.42
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4O33_A_TZNA501_1
(PHOSPHOGLYCERATE
KINASE 1)		 2ie8 PHOSPHOGLYCERATE
KINASE
(Thermus
caldophilus) 		8 / 12 GLY A 192
ALA A 193
PHE A 220
LEU A 234
MET A 288
LEU A 290
GLY A 317
VAL A 318
 None
 0.68A 4o33A-2ie8A:
51.1		 4o33A-2ie8A:
42.42
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4O3F_A_TZNA501_1
(PHOSPHOGLYCERATE
KINASE 1)		 2ie8 PHOSPHOGLYCERATE
KINASE
(Thermus
caldophilus) 		9 / 12 GLY A 192
ALA A 193
GLY A 216
PHE A 220
LEU A 234
MET A 288
LEU A 290
GLY A 317
VAL A 318
 None
 0.60A 4o3fA-2ie8A:
49.7		 4o3fA-2ie8A:
42.18
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.
4OJ4_A_DIFA501_1
(PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA)		 2ie8 PHOSPHOGLYCERATE
KINASE
(Thermus
caldophilus) 		4 / 8 SER A  93
LEU A 111
LEU A  55
VAL A  53
 None
 0.96A 4oj4A-2ie8A:
undetectable		 4oj4A-2ie8A:
20.00
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.
4OKW_A_198A1001_2
(ANDROGEN RECEPTOR)		 2ie8 PHOSPHOGLYCERATE
KINASE
(Thermus
caldophilus) 		4 / 7 LEU A 212
LEU A 226
MET A 218
LEU A 246
 None
 1.01A 4okwA-2ie8A:
undetectable		 4okwA-2ie8A:
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.
4PD5_A_GEOA501_1
(NUPC FAMILY PROTEIN)		 2ie8 PHOSPHOGLYCERATE
KINASE
(Thermus
caldophilus) 		5 / 12 GLY A  74
ALA A  76
VAL A  29
ASN A  21
SER A  56
 None
 1.06A 4pd5A-2ie8A:
undetectable		 4pd5A-2ie8A:
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.
4USW_A_ACTA1470_0
(ADENYLATE CYCLASE
TYPE 10)		 2ie8 PHOSPHOGLYCERATE
KINASE
(Thermus
caldophilus) 		4 / 6 LEU A  77
LEU A 109
VAL A 108
PHE A  86
 None
 1.00A 4uswA-2ie8A:
undetectable		 4uswA-2ie8A:
22.62
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.
4Z2E_H_TR6H101_1
(DNA GYRASE SUBUNIT A
DNA GYRASE SUBUNIT B
SYMMETRIZED E-SITE
DNA)		 2ie8 PHOSPHOGLYCERATE
KINASE
(Thermus
caldophilus) 		3 / 5 GLY A 144
GLY A 371
GLU A 375
 None
 0.52A 4z2eA-2ie8A:
undetectable
4z2eD-2ie8A:
undetectable		 4z2eA-2ie8A:
23.67
4z2eD-2ie8A:
23.00
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.
6HU9_H_PCFH604_0
(CYTOCHROME B-C1
COMPLEX SUBUNIT 8
CYTOCHROME C OXIDASE
POLYPEPTIDE 5A,
MITOCHONDRIAL)		 2ie8 PHOSPHOGLYCERATE
KINASE
(Thermus
caldophilus) 		4 / 8 GLY A 192
GLY A 346
SER A 350
ALA A 353
 None
 0.80A 6hu9H-2ie8A:
undetectable
6hu9e-2ie8A:
undetectable		 6hu9H-2ie8A:
11.48
6hu9e-2ie8A:
14.80