SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4ex4'

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.
1D1G_B_MTXB171_1
(DIHYDROFOLATE
REDUCTASE)		 4ex4 MALATE SYNTHASE G
(Mycobacterium
leprae) 		5 / 12 ALA A 542
ARG A 468
ILE A 504
LEU A 447
ILE A 461
 None
 1.21A 1d1gB-4ex4A:
undetectable		 1d1gB-4ex4A:
13.64
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1D8C_A_SORA4000_0
(MALATE SYNTHASE G)		 4ex4 MALATE SYNTHASE G
(Mycobacterium
leprae) 		3 / 3 GLN A  61
HIS A 474
PRO A 711
 None
 0.16A 1d8cA-4ex4A:
55.4		 1d8cA-4ex4A:
56.62
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.
1GSF_C_EAAC223_1
(GLUTATHIONE
TRANSFERASE A1-1)		 4ex4 MALATE SYNTHASE G
(Mycobacterium
leprae) 		4 / 8 TYR A 613
GLY A 623
ARG A 639
VAL A 118
 None
 0.99A 1gsfC-4ex4A:
undetectable		 1gsfC-4ex4A:
15.35
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.
1MT1_B_AG2B7001_1
(PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE ALPHA
CHAIN
PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE BETA
CHAIN)		 4ex4 MALATE SYNTHASE G
(Mycobacterium
leprae) 		4 / 6 GLU A 360
ARG A 724
LEU A 352
ASP A 349
 None
 1.03A 1mt1B-4ex4A:
undetectable
1mt1C-4ex4A:
undetectable		 1mt1B-4ex4A:
9.71
1mt1C-4ex4A:
6.67
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.
1PJ7_A_FFOA2887_0
(N,N-DIMETHYLGLYCINE
OXIDASE)		 4ex4 MALATE SYNTHASE G
(Mycobacterium
leprae) 		5 / 12 TYR A 289
GLY A 374
ASN A 341
PHE A  19
LEU A 293
 None
 1.47A 1pj7A-4ex4A:
undetectable		 1pj7A-4ex4A:
23.30
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.
1Q23_H_FUAH709_1
(CHLORAMPHENICOL
ACETYLTRANSFERASE)		 4ex4 MALATE SYNTHASE G
(Mycobacterium
leprae) 		5 / 12 PHE A 372
LEU A 425
VAL A 424
PHE A  35
VAL A  43
 None
 1.14A 1q23H-4ex4A:
undetectable
1q23I-4ex4A:
undetectable		 1q23H-4ex4A:
14.27
1q23I-4ex4A:
14.27
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.
2JFA_B_RALB600_2
(ESTROGEN RECEPTOR)		 4ex4 MALATE SYNTHASE G
(Mycobacterium
leprae) 		4 / 4 LEU A 584
THR A 585
ILE A  64
HIS A  68
 None
 1.14A 2jfaB-4ex4A:
undetectable		 2jfaB-4ex4A:
16.89
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.
2OKC_A_SAMA500_1
(TYPE I RESTRICTION
ENZYME STYSJI M
PROTEIN)		 4ex4 MALATE SYNTHASE G
(Mycobacterium
leprae) 		4 / 6 THR A 524
ASP A 629
ASN A 605
ASP A 606
 None
 1.23A 2okcA-4ex4A:
undetectable		 2okcA-4ex4A:
23.40
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.
2XFH_A_CL6A1413_1
(ERYTHROMYCIN B/D
C-12 HYDROXYLASE)		 4ex4 MALATE SYNTHASE G
(Mycobacterium
leprae) 		4 / 6 HIS A 556
GLN A 515
ALA A 266
THR A 269
 None
 1.05A 2xfhA-4ex4A:
undetectable		 2xfhA-4ex4A:
19.21
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.
2ZZM_A_SAMA401_0
(UNCHARACTERIZED
PROTEIN MJ0883)		 4ex4 MALATE SYNTHASE G
(Mycobacterium
leprae) 		5 / 12 LEU A 381
GLY A 426
PRO A 428
VAL A  39
LEU A 375
 None
 1.21A 2zzmA-4ex4A:
undetectable		 2zzmA-4ex4A:
19.24
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.
3EKW_B_DR7B100_1
(PROTEASE)		 4ex4 MALATE SYNTHASE G
(Mycobacterium
leprae) 		5 / 10 ALA A 514
ILE A 461
GLY A 435
ALA A 455
ILE A 100
 None
 0.98A 3ekwA-4ex4A:
undetectable		 3ekwA-4ex4A:
9.93
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.
3EL9_A_DR7A100_2
(PROTEASE)		 4ex4 MALATE SYNTHASE G
(Mycobacterium
leprae) 		5 / 10 GLY A 480
ALA A 479
ILE A  64
ILE A 473
THR A 585
 None
 0.99A 3el9B-4ex4A:
undetectable		 3el9B-4ex4A:
9.80
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.
3G2O_A_SAMA500_1
(PCZA361.24)		 4ex4 MALATE SYNTHASE G
(Mycobacterium
leprae) 		3 / 3 ARG A 340
GLU A 365
ASP A 281
 MG  A 801 ( 4.3A)
None
None
 0.91A 3g2oA-4ex4A:
undetectable		 3g2oA-4ex4A:
18.37
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.
3GP0_A_NILA1_2
(MITOGEN-ACTIVATED
PROTEIN KINASE 11)		 4ex4 MALATE SYNTHASE G
(Mycobacterium
leprae) 		4 / 7 VAL A 118
LEU A 122
LEU A 128
ILE A 270
 None
 0.82A 3gp0A-4ex4A:
undetectable		 3gp0A-4ex4A:
19.02
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.
3KU1_H_SAMH226_0
(SAM-DEPENDENT
METHYLTRANSFERASE)		 4ex4 MALATE SYNTHASE G
(Mycobacterium
leprae) 		5 / 12 GLY A 114
VAL A 563
PRO A 538
GLY A 237
ALA A 266
 None
 0.86A 3ku1H-4ex4A:
undetectable		 3ku1H-4ex4A:
16.23
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.
3ME6_A_CGEA501_1
(CYTOCHROME P450 2B4)		 4ex4 MALATE SYNTHASE G
(Mycobacterium
leprae) 		5 / 10 VAL A 105
PHE A 510
ALA A 455
ILE A 436
VAL A 434
 None
 1.10A 3me6A-4ex4A:
undetectable		 3me6A-4ex4A:
20.61
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.
3NAI_A_URFA521_1
(RNA DEPENDENT RNA
POLYMERASE)		 4ex4 MALATE SYNTHASE G
(Mycobacterium
leprae) 		4 / 5 ARG A 723
ASP A 281
ASP A 283
ARG A 287
 None
 1.43A 3naiA-4ex4A:
1.7		 3naiA-4ex4A:
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.
3W1W_A_CHDA1507_0
(FERROCHELATASE,
MITOCHONDRIAL)		 4ex4 MALATE SYNTHASE G
(Mycobacterium
leprae) 		3 / 3 ARG A 643
LYS A 404
ARG A 639
 None
MG  A 801 ( 4.0A)
None
 1.10A 3w1wA-4ex4A:
undetectable
3w1wB-4ex4A:
undetectable		 3w1wA-4ex4A:
19.45
3w1wB-4ex4A:
19.45
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.
3W1W_B_CHDB506_0
(FERROCHELATASE,
MITOCHONDRIAL)		 4ex4 MALATE SYNTHASE G
(Mycobacterium
leprae) 		3 / 3 ARG A 639
ARG A 643
LYS A 404
 None
None
MG  A 801 ( 4.0A)
 1.12A 3w1wA-4ex4A:
undetectable
3w1wB-4ex4A:
undetectable		 3w1wA-4ex4A:
19.45
3w1wB-4ex4A:
19.45
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.
4AZW_A_SAMA1451_0
(WBDD)		 4ex4 MALATE SYNTHASE G
(Mycobacterium
leprae) 		5 / 12 GLN A 537
ALA A 545
GLN A 116
ARG A 134
GLU A 264
 None
 1.20A 4azwA-4ex4A:
undetectable		 4azwA-4ex4A:
21.18
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.
4J4V_C_SVRC301_1
(NUCLEOCAPSID PROTEIN)		 4ex4 MALATE SYNTHASE G
(Mycobacterium
leprae) 		4 / 8 GLY A 294
ASN A 296
LYS A 297
PHE A  19
 None
 0.92A 4j4vC-4ex4A:
undetectable		 4j4vC-4ex4A:
14.93
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.
4MM5_A_SREA603_1
(TRANSPORTER)		 4ex4 MALATE SYNTHASE G
(Mycobacterium
leprae) 		5 / 9 ASP A 456
VAL A 459
ALA A 514
GLY A 430
SER A 101
 None
 1.31A 4mm5A-4ex4A:
undetectable		 4mm5A-4ex4A:
24.20
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.
4MME_A_29QA603_1
(TRANSPORTER)		 4ex4 MALATE SYNTHASE G
(Mycobacterium
leprae) 		5 / 9 ASP A 456
VAL A 459
ALA A 514
GLY A 430
SER A 101
 None
 1.31A 4mmeA-4ex4A:
undetectable		 4mmeA-4ex4A:
23.93
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.
4MME_B_29QB603_1
(TRANSPORTER)		 4ex4 MALATE SYNTHASE G
(Mycobacterium
leprae) 		5 / 9 ASP A 456
VAL A 459
ALA A 514
GLY A 430
SER A 101
 None
 1.31A 4mmeB-4ex4A:
undetectable		 4mmeB-4ex4A:
23.93
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.
4MMF_A_29QA603_1
(TRANSPORTER)		 4ex4 MALATE SYNTHASE G
(Mycobacterium
leprae) 		5 / 9 ASP A 456
VAL A 459
ALA A 514
GLY A 430
SER A 101
 None
 1.26A 4mmfA-4ex4A:
undetectable		 4mmfA-4ex4A:
23.89
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.
4PD4_C_AOQC4003_1
(CYTOCHROME B)		 4ex4 MALATE SYNTHASE G
(Mycobacterium
leprae) 		5 / 12 GLY A 656
VAL A 657
ILE A 658
LEU A 648
ILE A 610
 None
 1.07A 4pd4C-4ex4A:
undetectable		 4pd4C-4ex4A:
18.05
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.
4QOI_B_ML1B303_1
(RIBOSYLDIHYDRONICOTI
NAMIDE DEHYDROGENASE
[QUINONE])		 4ex4 MALATE SYNTHASE G
(Mycobacterium
leprae) 		5 / 11 GLY A 505
ILE A 461
GLY A 512
ILE A 100
PHE A  98
 None
 0.90A 4qoiA-4ex4A:
undetectable
4qoiB-4ex4A:
undetectable		 4qoiA-4ex4A:
17.32
4qoiB-4ex4A:
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.
4R38_C_RBFC201_2
(BLUE-LIGHT-ACTIVATED
HISTIDINE KINASE 2)		 4ex4 MALATE SYNTHASE G
(Mycobacterium
leprae) 		5 / 9 THR A 110
ILE A 516
LEU A 336
VAL A 401
PHE A 510
 None
 1.14A 4r38C-4ex4A:
undetectable		 4r38C-4ex4A:
11.55
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.
4UCK_B_SAMB2409_1
(RNA-DIRECTED RNA
POLYMERASE L)		 4ex4 MALATE SYNTHASE G
(Mycobacterium
leprae) 		4 / 6 SER A 645
GLY A 612
GLU A 637
ASP A 675
 None
 1.03A 4uckB-4ex4A:
undetectable		 4uckB-4ex4A:
19.46
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.
4WNU_A_QDNA602_1
(CYTOCHROME P450 2D6)		 4ex4 MALATE SYNTHASE G
(Mycobacterium
leprae) 		5 / 11 LEU A 719
PHE A 726
GLY A 612
LEU A 703
ALA A 699
 None
 1.14A 4wnuA-4ex4A:
undetectable		 4wnuA-4ex4A:
21.47
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.
5C0O_G_SAMG301_1
(TRNA
(ADENINE(58)-N(1))-M
ETHYLTRANSFERASE
TRMI)		 4ex4 MALATE SYNTHASE G
(Mycobacterium
leprae) 		3 / 3 GLU A 264
HIS A 239
ASP A 107
 None
 0.82A 5c0oG-4ex4A:
undetectable		 5c0oG-4ex4A:
17.60
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.
5E26_A_PAUA602_0
(PANTOTHENATE KINASE
2, MITOCHONDRIAL)		 4ex4 MALATE SYNTHASE G
(Mycobacterium
leprae) 		4 / 7 GLU A 498
GLY A 517
GLY A 541
ALA A 545
 None
 0.81A 5e26A-4ex4A:
2.3
5e26B-4ex4A:
undetectable		 5e26A-4ex4A:
17.70
5e26B-4ex4A:
17.70
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.
5E26_B_PAUB601_0
(PANTOTHENATE KINASE
2, MITOCHONDRIAL)		 4ex4 MALATE SYNTHASE G
(Mycobacterium
leprae) 		4 / 7 ALA A 545
GLU A 498
GLY A 517
GLY A 541
 None
 0.85A 5e26A-4ex4A:
2.3
5e26B-4ex4A:
undetectable		 5e26A-4ex4A:
17.70
5e26B-4ex4A:
17.70
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.
5E26_C_PAUC602_0
(PANTOTHENATE KINASE
2, MITOCHONDRIAL)		 4ex4 MALATE SYNTHASE G
(Mycobacterium
leprae) 		4 / 7 GLU A 498
GLY A 517
GLY A 541
ALA A 545
 None
 0.82A 5e26C-4ex4A:
undetectable
5e26D-4ex4A:
undetectable		 5e26C-4ex4A:
17.70
5e26D-4ex4A:
17.70
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.
5HUA_A_FK5A201_1
(FK506-BINDING
PROTEIN 1)		 4ex4 MALATE SYNTHASE G
(Mycobacterium
leprae) 		5 / 11 TYR A  81
ARG A 441
TRP A  67
LEU A  60
PHE A  84
 None
 1.33A 5huaA-4ex4A:
undetectable		 5huaA-4ex4A:
11.48
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.
5MLM_A_STRA401_1
(-)		 4ex4 MALATE SYNTHASE G
(Mycobacterium
leprae) 		5 / 12 PHE A 460
ILE A 461
ALA A 453
ILE A 451
CYH A 450
 None
 1.38A 5mlmA-4ex4A:
undetectable		 5mlmA-4ex4A:
19.86
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.
5SYJ_B_NIZB809_1
(CATALASE-PEROXIDASE)		 4ex4 MALATE SYNTHASE G
(Mycobacterium
leprae) 		4 / 8 GLU A 241
GLY A 219
LEU A 329
THR A 322
 None
 1.00A 5syjB-4ex4A:
1.7		 5syjB-4ex4A:
23.31
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.
5UUN_A_ACTA305_0
(GLUTATHIONE
S-TRANSFERASE-LIKE
PROTEIN)		 4ex4 MALATE SYNTHASE G
(Mycobacterium
leprae) 		3 / 3 THR A 475
MET A 477
HIS A  68
 None
 0.84A 5uunA-4ex4A:
undetectable		 5uunA-4ex4A:
19.39
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.
6BZO_C_FI8C1201_0
(DNA-DIRECTED RNA
POLYMERASE SUBUNIT
BETA)		 4ex4 MALATE SYNTHASE G
(Mycobacterium
leprae) 		5 / 12 ILE A 644
THR A 641
VAL A 118
VAL A 547
GLU A 716
 None
 1.39A 6bzoC-4ex4A:
undetectable		 6bzoC-4ex4A:
20.40
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.
6J20_A_GBQA1201_1
(SUBSTANCE-P
RECEPTOR,ENDOLYSIN)		 4ex4 MALATE SYNTHASE G
(Mycobacterium
leprae) 		4 / 7 ILE A 270
GLN A 116
VAL A 401
TRP A 292
 None
 0.90A 6j20A-4ex4A:
undetectable		 6j20A-4ex4A:
20.46
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.
6MN4_C_AM2C301_0
(AMINOGLYCOSIDE
N(3)-ACETYLTRANSFERA
SE, AAC(3)-IVA)		 4ex4 MALATE SYNTHASE G
(Mycobacterium
leprae) 		4 / 8 TRP A 617
HIS A 720
ARG A 643
GLU A 439
 None
None
None
MG  A 801 (-2.6A)
 1.12A 6mn4C-4ex4A:
undetectable		 6mn4C-4ex4A:
19.64