SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '5ws4'

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.
1DRA_A_MTXA161_1
(DIHYDROFOLATE
REDUCTASE)		 5ws4 MACROLIDE EXPORT
ATP-BINDING/PERMEASE
PROTEIN MACB
(Acinetobacter
baumannii) 		5 / 12 ILE A 200
GLU A  37
SER A 225
ILE A 223
ILE A  41
 None
 0.87A 1draA-5ws4A:
undetectable		 1draA-5ws4A:
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.
1FKO_A_EFZA999_1
(HIV-1 RT, A-CHAIN)		 5ws4 MACROLIDE EXPORT
ATP-BINDING/PERMEASE
PROTEIN MACB
(Acinetobacter
baumannii) 		5 / 10 VAL A 474
VAL A 387
TYR A 468
GLY A 386
LEU A 441
 None
 1.42A 1fkoA-5ws4A:
5.1		 1fkoA-5ws4A:
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.
1S9P_B_DESB459_2
(ESTROGEN-RELATED
RECEPTOR GAMMA)		 5ws4 MACROLIDE EXPORT
ATP-BINDING/PERMEASE
PROTEIN MACB
(Acinetobacter
baumannii) 		3 / 3 LEU A 507
HIS A 512
ILE A 517
 None
 0.60A 1s9pB-5ws4A:
2.0		 1s9pB-5ws4A:
17.07
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.
2BR4_A_SAMA301_0
(CEPHALOSPORIN
HYDROXYLASE CMCI)		 5ws4 MACROLIDE EXPORT
ATP-BINDING/PERMEASE
PROTEIN MACB
(Acinetobacter
baumannii) 		5 / 12 LEU A  31
LEU A  52
SER A  47
ALA A  40
ALA A 212
 None
None
AT4  A 801 (-4.1A)
None
None
 0.94A 2br4A-5ws4A:
undetectable		 2br4A-5ws4A:
16.22
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.
2BR4_D_SAMD301_0
(CEPHALOSPORIN
HYDROXYLASE CMCI)		 5ws4 MACROLIDE EXPORT
ATP-BINDING/PERMEASE
PROTEIN MACB
(Acinetobacter
baumannii) 		5 / 12 LEU A  31
LEU A  52
SER A  47
ALA A  40
ALA A 212
 None
None
AT4  A 801 (-4.1A)
None
None
 0.94A 2br4D-5ws4A:
undetectable		 2br4D-5ws4A:
16.22
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.
2BR4_F_SAMF301_0
(CEPHALOSPORIN
HYDROXYLASE CMCI)		 5ws4 MACROLIDE EXPORT
ATP-BINDING/PERMEASE
PROTEIN MACB
(Acinetobacter
baumannii) 		5 / 12 LEU A  31
LEU A  52
SER A  47
ALA A  40
ALA A 212
 None
None
AT4  A 801 (-4.1A)
None
None
 0.94A 2br4F-5ws4A:
undetectable		 2br4F-5ws4A:
16.22
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.
2OTH_A_NIMA300_1
(PHOSPHOLIPASE A2
VRV-PL-VIIIA)		 5ws4 MACROLIDE EXPORT
ATP-BINDING/PERMEASE
PROTEIN MACB
(Acinetobacter
baumannii) 		4 / 5 LEU A 136
ALA A 158
ILE A 157
SER A 156
 None
 0.98A 2othA-5ws4A:
0.9		 2othA-5ws4A:
11.40
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.
2XZ5_D_ACHD1211_0
(SOLUBLE
ACETYLCHOLINE
RECEPTOR)		 5ws4 MACROLIDE EXPORT
ATP-BINDING/PERMEASE
PROTEIN MACB
(Acinetobacter
baumannii) 		4 / 8 THR A 456
GLN A 455
GLN A 313
ASP A 462
 None
 1.27A 2xz5C-5ws4A:
undetectable
2xz5D-5ws4A:
undetectable		 2xz5C-5ws4A:
15.09
2xz5D-5ws4A:
15.09
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.
3FI0_M_TRPM1001_0
(TRYPTOPHANYL-TRNA
SYNTHETASE)		 5ws4 MACROLIDE EXPORT
ATP-BINDING/PERMEASE
PROTEIN MACB
(Acinetobacter
baumannii) 		5 / 9 ASP A 350
ILE A 487
VAL A 363
VAL A 360
GLN A 357
 None
 1.46A 3fi0M-5ws4A:
undetectable		 3fi0M-5ws4A:
18.96
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.
3K2H_A_LYAA514_1
(DIHYDROFOLATE
REDUCTASE/THYMIDYLAT
E SYNTHASE)		 5ws4 MACROLIDE EXPORT
ATP-BINDING/PERMEASE
PROTEIN MACB
(Acinetobacter
baumannii) 		5 / 12 ASP A 226
LEU A  31
THR A 198
ILE A 200
LEU A  56
 None
 1.08A 3k2hA-5ws4A:
undetectable		 3k2hA-5ws4A:
20.97
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.
3K2H_B_LYAB514_1
(DIHYDROFOLATE
REDUCTASE/THYMIDYLAT
E SYNTHASE)		 5ws4 MACROLIDE EXPORT
ATP-BINDING/PERMEASE
PROTEIN MACB
(Acinetobacter
baumannii) 		5 / 12 ILE A 199
ARG A 159
LEU A 161
ILE A 188
LEU A 134
 None
 0.85A 3k2hB-5ws4A:
undetectable		 3k2hB-5ws4A:
20.97
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)		 5ws4 MACROLIDE EXPORT
ATP-BINDING/PERMEASE
PROTEIN MACB
(Acinetobacter
baumannii) 		5 / 11 GLN A 152
PRO A 144
ASN A 108
VAL A 576
ALA A 575
 None
 1.37A 3n23A-5ws4A:
undetectable		 3n23A-5ws4A:
21.90
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_C_OBNC1_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)		 5ws4 MACROLIDE EXPORT
ATP-BINDING/PERMEASE
PROTEIN MACB
(Acinetobacter
baumannii) 		5 / 11 GLN A 152
PRO A 144
ASN A 108
VAL A 576
ALA A 575
 None
 1.38A 3n23C-5ws4A:
undetectable		 3n23C-5ws4A:
21.90
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.
4D33_A_ACTA860_0
(NITRIC OXIDE
SYNTHASE,
ENDOTHELIAL)		 5ws4 MACROLIDE EXPORT
ATP-BINDING/PERMEASE
PROTEIN MACB
(Acinetobacter
baumannii) 		4 / 5 GLY A 598
ILE A 293
VAL A 603
SER A 637
 None
 1.25A 4d33A-5ws4A:
undetectable		 4d33A-5ws4A:
21.63
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.
4D33_B_ACTB860_0
(NITRIC OXIDE
SYNTHASE,
ENDOTHELIAL)		 5ws4 MACROLIDE EXPORT
ATP-BINDING/PERMEASE
PROTEIN MACB
(Acinetobacter
baumannii) 		4 / 5 GLY A 598
ILE A 293
VAL A 603
SER A 637
 None
 1.24A 4d33B-5ws4A:
undetectable		 4d33B-5ws4A:
21.63
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.
4EAH_A_ACTA1002_0
(ACTIN, ALPHA
SKELETAL MUSCLE
FORMIN-LIKE PROTEIN
3)		 5ws4 MACROLIDE EXPORT
ATP-BINDING/PERMEASE
PROTEIN MACB
(Acinetobacter
baumannii) 		4 / 5 ARG A 526
THR A 325
GLN A 455
THR A 323
 None
 1.48A 4eahA-5ws4A:
undetectable
4eahE-5ws4A:
undetectable
4eahG-5ws4A:
undetectable		 4eahA-5ws4A:
19.55
4eahE-5ws4A:
19.55
4eahG-5ws4A:
19.76
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.
4FP9_C_SAMC401_1
(METHYLTRANSFERASE
NSUN4)		 5ws4 MACROLIDE EXPORT
ATP-BINDING/PERMEASE
PROTEIN MACB
(Acinetobacter
baumannii) 		3 / 3 ASP A 416
ARG A 447
ASP A 412
 None
 0.84A 4fp9C-5ws4A:
undetectable		 4fp9C-5ws4A:
18.90
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.
4FP9_F_SAMF401_1
(METHYLTRANSFERASE
NSUN4)		 5ws4 MACROLIDE EXPORT
ATP-BINDING/PERMEASE
PROTEIN MACB
(Acinetobacter
baumannii) 		3 / 3 ASP A 416
ARG A 447
ASP A 412
 None
 0.78A 4fp9F-5ws4A:
undetectable		 4fp9F-5ws4A:
18.90
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.
4J24_B_ESTB600_1
(ESTROGEN RECEPTOR
BETA)		 5ws4 MACROLIDE EXPORT
ATP-BINDING/PERMEASE
PROTEIN MACB
(Acinetobacter
baumannii) 		5 / 12 LEU A  31
LEU A   7
ILE A 223
ILE A 218
LEU A  12
 None
 1.21A 4j24B-5ws4A:
undetectable		 4j24B-5ws4A:
15.71
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.
4J7X_B_SASB804_1
(SEPIAPTERIN
REDUCTASE)		 5ws4 MACROLIDE EXPORT
ATP-BINDING/PERMEASE
PROTEIN MACB
(Acinetobacter
baumannii) 		5 / 12 LEU A 465
PHE A 427
ALA A 446
GLY A 442
LEU A 441
 None
 1.19A 4j7xB-5ws4A:
undetectable		 4j7xB-5ws4A:
18.69
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)		 5ws4 MACROLIDE EXPORT
ATP-BINDING/PERMEASE
PROTEIN MACB
(Acinetobacter
baumannii) 		5 / 12 GLN A 424
VAL A 439
PHE A 428
ASN A 433
ILE A 451
 None
 1.17A 4pd5A-5ws4A:
undetectable		 4pd5A-5ws4A:
22.90
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.
4PD9_A_ADNA501_1
(NUPC FAMILY PROTEIN)		 5ws4 MACROLIDE EXPORT
ATP-BINDING/PERMEASE
PROTEIN MACB
(Acinetobacter
baumannii) 		5 / 12 GLN A 424
VAL A 439
PHE A 428
ASN A 433
ILE A 451
 None
 1.14A 4pd9A-5ws4A:
undetectable		 4pd9A-5ws4A:
22.90
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.
4XNX_A_41XA707_1
(TRANSPORTER)		 5ws4 MACROLIDE EXPORT
ATP-BINDING/PERMEASE
PROTEIN MACB
(Acinetobacter
baumannii) 		5 / 11 ALA A 591
VAL A 594
GLY A 551
SER A 637
GLY A 641
 None
 0.96A 4xnxA-5ws4A:
undetectable		 4xnxA-5ws4A:
21.61
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.
4Y0R_A_PX9A201_0
(BETA-LACTOGLOBULIN)		 5ws4 MACROLIDE EXPORT
ATP-BINDING/PERMEASE
PROTEIN MACB
(Acinetobacter
baumannii) 		5 / 12 LEU A  38
ILE A 199
LEU A 192
ILE A 168
ILE A  93
 None
 0.87A 4y0rA-5ws4A:
undetectable		 4y0rA-5ws4A:
14.04
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.
4YIA_B_IMNB401_2
(THYROXINE-BINDING
GLOBULIN)		 5ws4 MACROLIDE EXPORT
ATP-BINDING/PERMEASE
PROTEIN MACB
(Acinetobacter
baumannii) 		3 / 3 LEU A  85
ARG A  87
ARG A  86
 None
 0.93A 4yiaB-5ws4A:
undetectable		 4yiaB-5ws4A:
6.03
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.
5AD9_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 5ws4 MACROLIDE EXPORT
ATP-BINDING/PERMEASE
PROTEIN MACB
(Acinetobacter
baumannii) 		4 / 7 VAL A 576
PHE A  94
HIS A  98
GLU A 569
 None
 1.42A 5ad9A-5ws4A:
undetectable
5ad9B-5ws4A:
undetectable		 5ad9A-5ws4A:
20.95
5ad9B-5ws4A:
20.95
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.
5VLM_E_CVIE301_1
(REGULATORY PROTEIN
TETR)		 5ws4 MACROLIDE EXPORT
ATP-BINDING/PERMEASE
PROTEIN MACB
(Acinetobacter
baumannii) 		4 / 7 GLN A 141
GLY A 107
GLN A 153
ASP A 102
 None
 1.14A 5vlmE-5ws4A:
undetectable		 5vlmE-5ws4A:
14.43
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.
6HD6_A_STIA603_1
(TYROSINE-PROTEIN
KINASE ABL1)		 5ws4 MACROLIDE EXPORT
ATP-BINDING/PERMEASE
PROTEIN MACB
(Acinetobacter
baumannii) 		4 / 5 LEU A  85
TYR A  89
ILE A 216
GLY A  71
 None
 1.09A 6hd6A-5ws4A:
undetectable		 6hd6A-5ws4A:
8.62
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.
6NM4_A_SAMA402_0
(HISTONE-LYSINE
N-METHYLTRANSFERASE
PRDM9)		 5ws4 MACROLIDE EXPORT
ATP-BINDING/PERMEASE
PROTEIN MACB
(Acinetobacter
baumannii) 		4 / 7 ALA A 298
GLY A 602
LEU A 601
GLY A 551
 None
 0.84A 6nm4A-5ws4A:
undetectable		 6nm4A-5ws4A:
14.76