SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3kya'

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.
2CL5_B_SAMB1217_1
(CATECHOL
O-METHYLTRANSFERASE)		 3kya PUTATIVE PHOSPHATASE
(Bacteroides
thetaiotaomicron) 		4 / 6 SER A  95
SER A 445
GLN A 451
ASP A 458
 EDO  A   2 ( 2.7A)
None
None
EDO  A   2 (-3.7A)
 1.23A 2cl5B-3kyaA:
undetectable		 2cl5B-3kyaA:
18.33
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.
2VXA_H_RBFH200_1
(DODECIN)		 3kya PUTATIVE PHOSPHATASE
(Bacteroides
thetaiotaomicron) 		4 / 8 HIS A 488
GLN A 142
TYR A 180
TRP A 144
 None
None
None
ACT  A  17 (-3.8A)
 1.44A 2vxaB-3kyaA:
undetectable
2vxaG-3kyaA:
undetectable
2vxaH-3kyaA:
undetectable		 2vxaB-3kyaA:
9.68
2vxaG-3kyaA:
9.68
2vxaH-3kyaA:
9.68
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.
2ZVJ_A_SAMA301_1
(CATECHOL
O-METHYLTRANSFERASE)		 3kya PUTATIVE PHOSPHATASE
(Bacteroides
thetaiotaomicron) 		4 / 6 SER A  95
SER A 445
GLN A 451
ASP A 458
 EDO  A   2 ( 2.7A)
None
None
EDO  A   2 (-3.7A)
 1.23A 2zvjA-3kyaA:
undetectable		 2zvjA-3kyaA:
18.53
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.
3BJW_E_SVRE510_3
(PHOSPHOLIPASE A2)		 3kya PUTATIVE PHOSPHATASE
(Bacteroides
thetaiotaomicron) 		4 / 5 VAL A 434
VAL A 428
THR A 389
THR A 436
 None
 1.21A 3bjwG-3kyaA:
undetectable		 3bjwG-3kyaA:
13.70
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.
3BJW_F_SVRF509_1
(PHOSPHOLIPASE A2)		 3kya PUTATIVE PHOSPHATASE
(Bacteroides
thetaiotaomicron) 		4 / 5 VAL A 434
VAL A 428
THR A 389
THR A 436
 None
 1.23A 3bjwC-3kyaA:
undetectable		 3bjwC-3kyaA:
13.70
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.
3BJW_H_SVRH511_2
(PHOSPHOLIPASE A2)		 3kya PUTATIVE PHOSPHATASE
(Bacteroides
thetaiotaomicron) 		4 / 5 VAL A 434
VAL A 428
THR A 389
THR A 436
 None
 1.24A 3bjwD-3kyaA:
undetectable		 3bjwD-3kyaA:
13.70
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.
3IW1_A_ASDA1223_1
(CYTOCHROME P450
CYP125)		 3kya PUTATIVE PHOSPHATASE
(Bacteroides
thetaiotaomicron) 		5 / 12 VAL A 400
GLN A 398
VAL A 418
ILE A 493
VAL A 482
 None
 1.17A 3iw1A-3kyaA:
undetectable		 3iw1A-3kyaA:
22.59
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.
3NDI_A_SAMA601_0
(METHYLTRANSFERASE)		 3kya PUTATIVE PHOSPHATASE
(Bacteroides
thetaiotaomicron) 		5 / 12 ILE A 337
PHE A 348
ALA A 274
THR A 275
ILE A 339
 None
 1.21A 3ndiA-3kyaA:
undetectable		 3ndiA-3kyaA:
21.66
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.
3NDU_D_ROCD100_3
(PROTEASE)		 3kya PUTATIVE PHOSPHATASE
(Bacteroides
thetaiotaomicron) 		3 / 3 ARG A 466
VAL A 462
THR A 444
 None
 0.75A 3nduD-3kyaA:
undetectable		 3nduD-3kyaA:
11.09
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.
3TL9_A_ROCA401_2
(PROTEASE)		 3kya PUTATIVE PHOSPHATASE
(Bacteroides
thetaiotaomicron) 		3 / 3 ARG A 466
VAL A 462
THR A 444
 None
 0.85A 3tl9A-3kyaA:
undetectable		 3tl9A-3kyaA:
12.03
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.
4KOW_A_CFXA204_1
(UNCHARACTERIZED
PROTEIN)		 3kya PUTATIVE PHOSPHATASE
(Bacteroides
thetaiotaomicron) 		5 / 12 PHE A 356
ARG A 211
GLY A 273
ASN A 272
PHE A 338
 None
EDO  A   1 (-4.6A)
None
EDO  A   1 (-3.7A)
None
 1.38A 4kowA-3kyaA:
undetectable		 4kowA-3kyaA:
15.29
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.
4MM4_B_8PRB603_2
(TRANSPORTER)		 3kya PUTATIVE PHOSPHATASE
(Bacteroides
thetaiotaomicron) 		3 / 3 SER A 494
MET A 479
ASP A 484
 None
 0.87A 4mm4B-3kyaA:
undetectable		 4mm4B-3kyaA:
21.11
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.
4PB1_A_RBVA501_1
(NUPC FAMILY PROTEIN)		 3kya PUTATIVE PHOSPHATASE
(Bacteroides
thetaiotaomicron) 		5 / 12 GLY A 273
GLN A 336
ALA A 232
ASN A 163
ILE A 351
 None
None
None
CL  A  21 (-4.4A)
CL  A  21 (-4.4A)
 1.31A 4pb1A-3kyaA:
undetectable		 4pb1A-3kyaA:
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.
4RZV_B_032B801_2
(SERINE/THREONINE-PRO
TEIN KINASE B-RAF)		 3kya PUTATIVE PHOSPHATASE
(Bacteroides
thetaiotaomicron) 		4 / 5 ILE A 351
PHE A 285
SER A 469
ASP A 234
 CL  A  21 (-4.4A)
None
None
EDO  A   1 (-2.8A)
 1.33A 4rzvB-3kyaA:
undetectable		 4rzvB-3kyaA:
20.88
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.
5D4N_C_ACTC201_0
(NITROGEN REGULATORY
PROTEIN P-II)		 3kya PUTATIVE PHOSPHATASE
(Bacteroides
thetaiotaomicron) 		4 / 5 VAL A 482
VAL A 129
GLY A 130
PHE A 465
 None
 0.89A 5d4nA-3kyaA:
undetectable
5d4nC-3kyaA:
undetectable		 5d4nA-3kyaA:
13.20
5d4nC-3kyaA:
13.20
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.
5DNU_A_BEZA319_0
(SHKAI2IB)		 3kya PUTATIVE PHOSPHATASE
(Bacteroides
thetaiotaomicron) 		4 / 5 GLN A 187
ILE A 178
ILE A 213
TYR A 180
 None
 1.10A 5dnuA-3kyaA:
undetectable		 5dnuA-3kyaA:
20.75
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.
5DNV_A_BEZA304_0
(SHKAI2IB)		 3kya PUTATIVE PHOSPHATASE
(Bacteroides
thetaiotaomicron) 		4 / 5 GLN A 187
ILE A 178
ILE A 213
TYR A 180
 None
 1.11A 5dnvA-3kyaA:
undetectable		 5dnvA-3kyaA:
20.75
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.
5FHR_B_SAMB303_1
(CATECHOL
O-METHYLTRANSFERASE)		 3kya PUTATIVE PHOSPHATASE
(Bacteroides
thetaiotaomicron) 		4 / 5 SER A  95
SER A 445
GLN A 451
ASP A 458
 EDO  A   2 ( 2.7A)
None
None
EDO  A   2 (-3.7A)
 1.21A 5fhrB-3kyaA:
undetectable		 5fhrB-3kyaA:
17.78
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.
5FSA_A_X2NA590_1
(CYP51 VARIANT1)		 3kya PUTATIVE PHOSPHATASE
(Bacteroides
thetaiotaomicron) 		5 / 12 ALA A 223
TYR A 177
ILE A 189
PHE A 215
PHE A 256
 None
 1.12A 5fsaA-3kyaA:
undetectable		 5fsaA-3kyaA:
22.30
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.
5KSN_B_NIZB809_1
(CATALASE-PEROXIDASE)		 3kya PUTATIVE PHOSPHATASE
(Bacteroides
thetaiotaomicron) 		5 / 9 VAL A 315
GLY A 291
SER A 287
GLN A 324
THR A 327
 None
 1.47A 5ksnB-3kyaA:
undetectable		 5ksnB-3kyaA:
19.43
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.
5X6Y_A_SAMA902_1
(MRNA CAPPING ENZYME
P5)		 3kya PUTATIVE PHOSPHATASE
(Bacteroides
thetaiotaomicron) 		3 / 3 TYR A 177
ASP A 190
ASP A 169
 None
ZN  A 519 (-2.5A)
EDO  A  11 ( 4.2A)
 0.75A 5x6yA-3kyaA:
undetectable		 5x6yA-3kyaA:
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.
5ZW4_A_SAMA302_1
(PUTATIVE
O-METHYLTRANSFERASE
YRRM)		 3kya PUTATIVE PHOSPHATASE
(Bacteroides
thetaiotaomicron) 		4 / 6 ARG A 464
ARG A 440
ASP A 455
ASP A 467
 None
 0.85A 5zw4A-3kyaA:
undetectable		 5zw4A-3kyaA:
19.07
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.
6AG0_C_ACRC605_0
(ALPHA-AMYLASE)		 3kya PUTATIVE PHOSPHATASE
(Bacteroides
thetaiotaomicron) 		4 / 8 GLY A 343
ILE A 339
ASP A 360
PRO A 371
 None
None
EDO  A   8 (-2.9A)
None
 0.97A 6ag0C-3kyaA:
undetectable		 6ag0C-3kyaA:
10.40
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.
6BP4_A_SAMA505_1
(HISTONE-LYSINE
N-METHYLTRANSFERASE,
H3 LYSINE-9 SPECIFIC)		 3kya PUTATIVE PHOSPHATASE
(Bacteroides
thetaiotaomicron) 		3 / 3 ILE A 351
ASN A 394
CYH A 424
 CL  A  21 (-4.4A)
None
None
 0.81A 6bp4A-3kyaA:
undetectable		 6bp4A-3kyaA:
19.96
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.
6CNJ_D_NCTD402_1
(NEURONAL
ACETYLCHOLINE
RECEPTOR SUBUNIT
ALPHA-4
NEURONAL
ACETYLCHOLINE
RECEPTOR SUBUNIT
BETA-2)		 3kya PUTATIVE PHOSPHATASE
(Bacteroides
thetaiotaomicron) 		4 / 8 TYR A 180
THR A 489
CYH A 157
TRP A 144
 None
None
None
ACT  A  17 (-3.8A)
 1.22A 6cnjD-3kyaA:
undetectable
6cnjE-3kyaA:
undetectable		 6cnjD-3kyaA:
8.27
6cnjE-3kyaA:
9.85
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.
6FGD_A_ACTA821_0
(GEPHYRIN)		 3kya PUTATIVE PHOSPHATASE
(Bacteroides
thetaiotaomicron) 		3 / 3 ARG A 464
PHE A 423
GLY A 453
 None
 0.48A 6fgdA-3kyaA:
undetectable		 6fgdA-3kyaA:
19.96
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.
6G6R_A_SAMA406_0
(S-ADENOSYLMETHIONINE
SYNTHASE ISOFORM
TYPE-2)		 3kya PUTATIVE PHOSPHATASE
(Bacteroides
thetaiotaomicron) 		4 / 7 PRO A 170
ASP A 169
SER A 260
PHE A 256
 None
EDO  A  11 ( 4.2A)
None
None
 1.33A 6g6rA-3kyaA:
undetectable		 6g6rA-3kyaA:
23.02