SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '5e4r'

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.
1FM6_D_BRLD503_1
(PEROXISOME
PROLIFERATOR
ACTIVATED RECEPTOR
GAMMA)		 5e4r KETOL-ACID
REDUCTOISOMERASE
(Ignisphaera
aggregans) 		5 / 12 GLY A 348
LEU A 248
MET A 247
LEU A 379
LEU A 206
 None
 1.46A 1fm6D-5e4rA:
undetectable		 1fm6D-5e4rA:
21.38
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.
1GM7_B_PNNB1577_0
(PENICILLIN G ACYLASE
ALPHA SUBUNIT
PENICILLIN G ACYLASE
BETA SUBUNIT)		 5e4r KETOL-ACID
REDUCTOISOMERASE
(Ignisphaera
aggregans) 		4 / 8 MET A  84
ALA A 288
PHE A 114
ILE A 292
 None
 1.14A 1gm7A-5e4rA:
undetectable
1gm7B-5e4rA:
undetectable		 1gm7A-5e4rA:
17.60
1gm7B-5e4rA:
21.64
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.
2BJF_A_DXCA330_0
(CHOLOYLGLYCINE
HYDROLASE)		 5e4r KETOL-ACID
REDUCTOISOMERASE
(Ignisphaera
aggregans) 		5 / 12 MET A 472
TYR A 372
PHE A 373
ILE A 198
LEU A 381
 None
 1.29A 2bjfA-5e4rA:
undetectable		 2bjfA-5e4rA:
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.
2EJG_A_ADNA1501_1
(235AA LONG
HYPOTHETICAL
BIOTIN--[ACETYL-COA-
CARBOXYLASE] LIGASE)		 5e4r KETOL-ACID
REDUCTOISOMERASE
(Ignisphaera
aggregans) 		4 / 7 GLU A  13
LYS A 170
PRO A  14
ALA A 167
 None
GOL  A 506 (-4.6A)
None
None
 1.32A 2ejgA-5e4rA:
undetectable		 2ejgA-5e4rA:
20.08
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.
2EJG_B_ADNB1502_1
(235AA LONG
HYPOTHETICAL
BIOTIN--[ACETYL-COA-
CARBOXYLASE] LIGASE)		 5e4r KETOL-ACID
REDUCTOISOMERASE
(Ignisphaera
aggregans) 		4 / 7 GLU A  13
LYS A 170
PRO A  14
ALA A 167
 None
GOL  A 506 (-4.6A)
None
None
 1.36A 2ejgB-5e4rA:
undetectable		 2ejgB-5e4rA:
20.08
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.
2KAW_A_SUZA91_1
(SEGMENT POLARITY
PROTEIN DISHEVELLED
HOMOLOG DVL-1)		 5e4r KETOL-ACID
REDUCTOISOMERASE
(Ignisphaera
aggregans) 		5 / 11 LEU A 379
ILE A 386
VAL A 229
LEU A 232
VAL A 236
 None
 0.97A 2kawA-5e4rA:
undetectable		 2kawA-5e4rA:
11.53
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.
2KCE_B_D16B568_1
(THYMIDYLATE SYNTHASE)		 5e4r KETOL-ACID
REDUCTOISOMERASE
(Ignisphaera
aggregans) 		5 / 12 SER A  88
TRP A  90
LEU A  23
VAL A  71
ALA A  74
 None
None
EDO  A 505 (-3.7A)
None
None
 1.23A 2kceB-5e4rA:
undetectable		 2kceB-5e4rA:
19.67
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.
2QMM_B_SAMB301_0
(UPF0217 PROTEIN
AF_1056)		 5e4r KETOL-ACID
REDUCTOISOMERASE
(Ignisphaera
aggregans) 		5 / 11 SER A 132
ILE A 172
GLY A 173
GLY A 146
SER A  27
 None
None
None
None
NAP  A 501 (-3.4A)
 0.88A 2qmmA-5e4rA:
undetectable
2qmmB-5e4rA:
undetectable		 2qmmA-5e4rA:
18.33
2qmmB-5e4rA:
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.
3ABK_W_CHDW1059_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE 7A1
CYTOCHROME C OXIDASE
SUBUNIT 1)		 5e4r KETOL-ACID
REDUCTOISOMERASE
(Ignisphaera
aggregans) 		4 / 5 ILE A 203
ARG A 322
MET A 394
THR A 392
 None
 1.24A 3abkN-5e4rA:
undetectable
3abkW-5e4rA:
undetectable		 3abkN-5e4rA:
23.43
3abkW-5e4rA:
7.14
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.
3ABK_W_CHDW1059_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE 7A1
CYTOCHROME C OXIDASE
SUBUNIT 1)		 5e4r KETOL-ACID
REDUCTOISOMERASE
(Ignisphaera
aggregans) 		4 / 5 ILE A 350
ARG A 469
MET A 247
THR A 245
 None
 1.13A 3abkN-5e4rA:
undetectable
3abkW-5e4rA:
undetectable		 3abkN-5e4rA:
23.43
3abkW-5e4rA:
7.14
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.
3AG4_J_CHDJ60_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE 7A1)		 5e4r KETOL-ACID
REDUCTOISOMERASE
(Ignisphaera
aggregans) 		4 / 5 ARG A 469
MET A 247
THR A 245
LEU A 248
 None
 1.43A 3ag4J-5e4rA:
undetectable		 3ag4J-5e4rA:
7.14
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.
3EBZ_B_017B201_2
(PROTEASE)		 5e4r KETOL-ACID
REDUCTOISOMERASE
(Ignisphaera
aggregans) 		5 / 11 LEU A 166
ALA A 149
ILE A 172
VAL A 137
GLY A 146
 None
 0.87A 3ebzB-5e4rA:
undetectable		 3ebzB-5e4rA:
12.84
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.
3QOW_A_SAMA417_1
(HISTONE-LYSINE
N-METHYLTRANSFERASE)		 5e4r KETOL-ACID
REDUCTOISOMERASE
(Ignisphaera
aggregans) 		3 / 3 THR A 401
ASP A 191
GLU A 378
 None
MG  A 502 (-2.6A)
MG  A 503 (-3.8A)
 0.82A 3qowA-5e4rA:
3.9		 3qowA-5e4rA:
23.55
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.
3R24_A_SAMA302_1
(2'-O-METHYL
TRANSFERASE)		 5e4r KETOL-ACID
REDUCTOISOMERASE
(Ignisphaera
aggregans) 		3 / 3 TYR A  25
ASP A  38
ASP A  60
 None
 0.65A 3r24A-5e4rA:
undetectable		 3r24A-5e4rA:
21.46
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.
3SUD_C_SUEC1201_2
(NS3 PROTEASE, NS4A
PROTEIN)		 5e4r KETOL-ACID
REDUCTOISOMERASE
(Ignisphaera
aggregans) 		4 / 4 PHE A 110
TYR A 404
LEU A  89
LYS A  87
 None
None
EDO  A 505 (-4.4A)
None
 1.01A 3sudC-5e4rA:
0.0		 3sudC-5e4rA:
17.29
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.
3SUE_C_SUEC1201_2
(NS3 PROTEASE, NS4A
PROTEIN)		 5e4r KETOL-ACID
REDUCTOISOMERASE
(Ignisphaera
aggregans) 		4 / 5 PHE A 110
TYR A 404
LEU A  89
LYS A  87
 None
None
EDO  A 505 (-4.4A)
None
 1.02A 3sueC-5e4rA:
undetectable		 3sueC-5e4rA:
17.29
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.
3SUE_D_SUED1201_2
(NS3 PROTEASE, NS4A
PROTEIN)		 5e4r KETOL-ACID
REDUCTOISOMERASE
(Ignisphaera
aggregans) 		3 / 3 TYR A 404
LEU A  89
LYS A  87
 None
EDO  A 505 (-4.4A)
None
 0.64A 3sueD-5e4rA:
undetectable		 3sueD-5e4rA:
17.29
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.
3SUG_A_SUEA1201_2
(NS3 PROTEASE, NS4A
PROTEIN)		 5e4r KETOL-ACID
REDUCTOISOMERASE
(Ignisphaera
aggregans) 		4 / 5 PHE A 110
TYR A 404
LEU A  89
LYS A  87
 None
None
EDO  A 505 (-4.4A)
None
 1.02A 3sugA-5e4rA:
undetectable		 3sugA-5e4rA:
17.29
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.
3T3C_A_017A201_2
(HIV-1 PROTEASE)		 5e4r KETOL-ACID
REDUCTOISOMERASE
(Ignisphaera
aggregans) 		5 / 10 ALA A 165
ILE A  10
GLY A 171
ALA A 149
VAL A 151
 None
None
GOL  A 506 ( 4.9A)
None
None
 0.94A 3t3cB-5e4rA:
undetectable		 3t3cB-5e4rA:
12.78
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.
3TKA_A_SAMA400_0
(RIBOSOMAL RNA SMALL
SUBUNIT
METHYLTRANSFERASE H)		 5e4r KETOL-ACID
REDUCTOISOMERASE
(Ignisphaera
aggregans) 		5 / 12 GLY A 146
ARG A 176
GLY A 178
ARG A 139
GLU A 388
 None
GOL  A 506 (-3.8A)
None
None
None
 1.42A 3tkaA-5e4rA:
4.4		 3tkaA-5e4rA:
21.83
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.
3W9T_A_W9TA1002_1
(HEMOLYTIC LECTIN
CEL-III)		 5e4r KETOL-ACID
REDUCTOISOMERASE
(Ignisphaera
aggregans) 		3 / 3 ASP A 124
GLU A 160
GLY A 159
 None
 0.58A 3w9tA-5e4rA:
undetectable		 3w9tA-5e4rA:
21.01
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.
4AWU_A_4CHA502_0
(OXIDOREDUCTASE,
FMN-BINDING)		 5e4r KETOL-ACID
REDUCTOISOMERASE
(Ignisphaera
aggregans) 		4 / 7 THR A 188
TYR A 366
LEU A 279
PHE A 114
 None
 1.26A 4awuA-5e4rA:
undetectable		 4awuA-5e4rA:
20.96
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.
4EQ4_B_SALB601_1
(4-SUBSTITUTED
BENZOATES-GLUTAMATE
LIGASE GH3.12)		 5e4r KETOL-ACID
REDUCTOISOMERASE
(Ignisphaera
aggregans) 		4 / 8 TYR A 366
ILE A 282
VAL A 278
GLY A 194
 None
 0.86A 4eq4B-5e4rA:
2.1		 4eq4B-5e4rA:
22.65
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.
4KUK_A_RBFA201_2
(BLUE-LIGHT
PHOTORECEPTOR)		 5e4r KETOL-ACID
REDUCTOISOMERASE
(Ignisphaera
aggregans) 		5 / 9 MET A 472
VAL A 236
ILE A 239
ILE A 354
GLY A 465
 None
 1.09A 4kukA-5e4rA:
undetectable		 4kukA-5e4rA:
15.92
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.
4QVN_K_BO2K301_1
(PROTEASOME SUBUNIT
BETA TYPE-5
PROTEASOME SUBUNIT
BETA TYPE-6)		 5e4r KETOL-ACID
REDUCTOISOMERASE
(Ignisphaera
aggregans) 		5 / 9 ALA A 169
ALA A 165
VAL A 147
GLY A 178
ALA A 149
 None
 0.98A 4qvnK-5e4rA:
undetectable
4qvnL-5e4rA:
undetectable		 4qvnK-5e4rA:
19.06
4qvnL-5e4rA:
18.72
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.
4QVN_Y_BO2Y301_1
(PROTEASOME SUBUNIT
BETA TYPE-5
PROTEASOME SUBUNIT
BETA TYPE-6)		 5e4r KETOL-ACID
REDUCTOISOMERASE
(Ignisphaera
aggregans) 		5 / 9 ALA A 169
ALA A 165
VAL A 147
GLY A 178
ALA A 149
 None
 0.99A 4qvnY-5e4rA:
undetectable
4qvnZ-5e4rA:
undetectable		 4qvnY-5e4rA:
19.06
4qvnZ-5e4rA:
18.72
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.
4WG0_C_CHDC102_0
(NUCLEAR RECEPTOR
COACTIVATOR 2)		 5e4r KETOL-ACID
REDUCTOISOMERASE
(Ignisphaera
aggregans) 		4 / 7 GLU A  13
LEU A  12
ASN A  42
LEU A  41
 None
GOL  A 506 (-4.4A)
None
None
 0.78A 4wg0B-5e4rA:
undetectable
4wg0C-5e4rA:
undetectable		 4wg0B-5e4rA:
11.34
4wg0C-5e4rA:
11.34
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.
4WG0_L_CHDL103_0
(NUCLEAR RECEPTOR
COACTIVATOR 2)		 5e4r KETOL-ACID
REDUCTOISOMERASE
(Ignisphaera
aggregans) 		4 / 7 ASN A  42
LEU A  41
GLU A  13
LEU A  12
 None
None
None
GOL  A 506 (-4.4A)
 0.81A 4wg0L-5e4rA:
undetectable
4wg0M-5e4rA:
undetectable		 4wg0L-5e4rA:
11.34
4wg0M-5e4rA:
11.34
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.
4XUD_A_SAMA303_0
(CATECHOL
O-METHYLTRANSFERASE)		 5e4r KETOL-ACID
REDUCTOISOMERASE
(Ignisphaera
aggregans) 		5 / 12 MET A 394
GLU A 205
GLY A 201
ILE A 413
ILE A 198
 None
 1.27A 4xudA-5e4rA:
4.1		 4xudA-5e4rA:
20.09
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.
5HW8_A_FK5A201_1
(FK506-BINDING
PROTEIN 1)		 5e4r KETOL-ACID
REDUCTOISOMERASE
(Ignisphaera
aggregans) 		5 / 11 VAL A 236
ILE A 239
ILE A 461
ILE A 414
ILE A 413
 None
 1.14A 5hw8A-5e4rA:
undetectable
5hw8D-5e4rA:
undetectable		 5hw8A-5e4rA:
13.39
5hw8D-5e4rA:
13.39
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.
5JH7_B_6K9B503_0
(TUBULIN BETA-2B
CHAIN)		 5e4r KETOL-ACID
REDUCTOISOMERASE
(Ignisphaera
aggregans) 		5 / 11 VAL A 398
SER A 399
ASP A 400
THR A 401
PRO A 135
 40E  A 504 ( 3.7A)
40E  A 504 ( 2.5A)
NAP  A 501 ( 4.4A)
None
None
 1.44A 5jh7B-5e4rA:
undetectable		 5jh7B-5e4rA:
22.76
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.
5JH7_D_6K9D502_0
(TUBULIN BETA-2B
CHAIN)		 5e4r KETOL-ACID
REDUCTOISOMERASE
(Ignisphaera
aggregans) 		5 / 11 VAL A 398
SER A 399
ASP A 400
THR A 401
PRO A 135
 40E  A 504 ( 3.7A)
40E  A 504 ( 2.5A)
NAP  A 501 ( 4.4A)
None
None
 1.44A 5jh7D-5e4rA:
undetectable		 5jh7D-5e4rA:
22.76
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.
5SYE_B_TA1B502_1
(TUBULIN BETA CHAIN)		 5e4r KETOL-ACID
REDUCTOISOMERASE
(Ignisphaera
aggregans) 		5 / 12 GLU A 181
VAL A 151
ASP A   9
ALA A 169
PRO A 130
 None
 1.20A 5syeB-5e4rA:
3.0		 5syeB-5e4rA:
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.
5UIH_A_8CVA201_1
(DIHYDROFOLATE
REDUCTASE)		 5e4r KETOL-ACID
REDUCTOISOMERASE
(Ignisphaera
aggregans) 		4 / 8 ILE A  20
ALA A  74
LEU A 104
ILE A  22
 None
 0.76A 5uihA-5e4rA:
undetectable		 5uihA-5e4rA:
12.18
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.
5X1B_W_CHDW101_0
(CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)		 5e4r KETOL-ACID
REDUCTOISOMERASE
(Ignisphaera
aggregans) 		4 / 5 ARG A 469
MET A 247
THR A 245
LEU A 248
 None
 1.46A 5x1bW-5e4rA:
undetectable		 5x1bW-5e4rA:
7.14
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.
5X7P_B_ACRB1421_1
(GLYCOSIDE HYDROLASE
FAMILY 31
ALPHA-GLUCOSIDASE)		 5e4r KETOL-ACID
REDUCTOISOMERASE
(Ignisphaera
aggregans) 		4 / 6 MET A 394
GLU A 378
GLY A 201
GLY A 410
 None
MG  A 503 (-3.8A)
None
None
 0.91A 5x7pB-5e4rA:
undetectable		 5x7pB-5e4rA:
16.84