SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4ayr'

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.
1CEA_A_ACAA90_1
(PLASMINOGEN)		 4ayr MANNOSYL-OLIGOSACCHA
RIDE
1,2-ALPHA-MANNOSIDAS
E
(Caulobacter
sp.
K31) 		4 / 8 ASP A 349
TYR A 336
ARG A 289
THR A 351
 None
 1.40A 1ceaA-4ayrA:
undetectable
1ceaB-4ayrA:
undetectable		 1ceaA-4ayrA:
12.81
1ceaB-4ayrA:
12.81
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.
1D4S_A_TPVA201_1
(PROTEIN (HIV-1
PROTEASE))		 4ayr MANNOSYL-OLIGOSACCHA
RIDE
1,2-ALPHA-MANNOSIDAS
E
(Caulobacter
sp.
K31) 		5 / 10 ALA A 248
ASP A 249
ASP A 245
ILE A 244
PHE A 297
 None
IFL  A 504 (-2.8A)
None
None
None
 1.18A 1d4sA-4ayrA:
undetectable		 1d4sA-4ayrA:
13.94
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.
1EKJ_C_ACTC3004_0
(BETA-CARBONIC
ANHYDRASE)		 4ayr MANNOSYL-OLIGOSACCHA
RIDE
1,2-ALPHA-MANNOSIDAS
E
(Caulobacter
sp.
K31) 		4 / 6 GLN A  99
ASP A 103
VAL A 105
GLY A 101
 PE4  A 512 (-4.3A)
None
None
None
 1.15A 1ekjC-4ayrA:
undetectable
1ekjD-4ayrA:
undetectable		 1ekjC-4ayrA:
18.00
1ekjD-4ayrA:
18.00
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.
1EKJ_C_ACTC3007_0
(BETA-CARBONIC
ANHYDRASE)		 4ayr MANNOSYL-OLIGOSACCHA
RIDE
1,2-ALPHA-MANNOSIDAS
E
(Caulobacter
sp.
K31) 		4 / 6 ASP A 103
VAL A 105
GLY A 101
GLN A  99
 None
None
None
PE4  A 512 (-4.3A)
 1.13A 1ekjC-4ayrA:
undetectable
1ekjD-4ayrA:
undetectable		 1ekjC-4ayrA:
18.00
1ekjD-4ayrA:
18.00
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.
1JLB_A_NVPA999_1
(HIV-1 RT A-CHAIN)		 4ayr MANNOSYL-OLIGOSACCHA
RIDE
1,2-ALPHA-MANNOSIDAS
E
(Caulobacter
sp.
K31) 		4 / 8 LEU A 149
VAL A  83
GLY A 129
LEU A  78
 None
None
NA  A 502 ( 4.3A)
None
 0.92A 1jlbA-4ayrA:
undetectable		 1jlbA-4ayrA:
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.
1JLB_A_NVPA999_1
(HIV-1 RT A-CHAIN)		 4ayr MANNOSYL-OLIGOSACCHA
RIDE
1,2-ALPHA-MANNOSIDAS
E
(Caulobacter
sp.
K31) 		4 / 8 LEU A 371
GLY A 316
LEU A 449
TYR A 431
 None
 0.93A 1jlbA-4ayrA:
undetectable		 1jlbA-4ayrA:
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.
1LF9_A_ACRA700_1
(GLUCOAMYLASE)		 4ayr MANNOSYL-OLIGOSACCHA
RIDE
1,2-ALPHA-MANNOSIDAS
E
(Caulobacter
sp.
K31) 		5 / 12 ALA A  47
TRP A 424
GLN A 428
GLU A 452
ASN A 454
 None
None
None
IFL  A 503 (-3.1A)
NA  A 502 (-3.1A)
 1.44A 1lf9A-4ayrA:
15.4		 1lf9A-4ayrA:
21.97
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.
1LF9_B_ACRB701_1
(GLUCOAMYLASE)		 4ayr MANNOSYL-OLIGOSACCHA
RIDE
1,2-ALPHA-MANNOSIDAS
E
(Caulobacter
sp.
K31) 		5 / 12 ALA A  47
TRP A 424
GLN A 428
GLU A 452
ASN A 454
 None
None
None
IFL  A 503 (-3.1A)
NA  A 502 (-3.1A)
 1.46A 1lf9B-4ayrA:
14.9		 1lf9B-4ayrA:
21.97
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.
2FL5_F_RBFF204_1
(IMMUNOGLOBULIN IGG1
LAMBDA LIGHT CHAIN
IMMUNOGLOBULIN IGG1
HEAVY CHAIN)		 4ayr MANNOSYL-OLIGOSACCHA
RIDE
1,2-ALPHA-MANNOSIDAS
E
(Caulobacter
sp.
K31) 		4 / 8 TYR A 314
ARG A 285
PHE A 292
VAL A 350
 None
 1.16A 2fl5E-4ayrA:
undetectable
2fl5F-4ayrA:
undetectable		 2fl5E-4ayrA:
18.75
2fl5F-4ayrA:
19.13
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.
2RLF_A_RIMA199_1
(MATRIX PROTEIN 2)		 4ayr MANNOSYL-OLIGOSACCHA
RIDE
1,2-ALPHA-MANNOSIDAS
E
(Caulobacter
sp.
K31) 		4 / 6 LEU A  78
LEU A  80
ASP A  59
ILE A  73
 None
 1.01A 2rlfA-4ayrA:
undetectable
2rlfB-4ayrA:
undetectable		 2rlfA-4ayrA:
6.78
2rlfB-4ayrA:
6.78
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.
2RLF_B_RIMB299_1
(MATRIX PROTEIN 2)		 4ayr MANNOSYL-OLIGOSACCHA
RIDE
1,2-ALPHA-MANNOSIDAS
E
(Caulobacter
sp.
K31) 		4 / 6 LEU A  78
LEU A  80
ASP A  59
ILE A  73
 None
 1.02A 2rlfB-4ayrA:
undetectable
2rlfC-4ayrA:
undetectable		 2rlfB-4ayrA:
6.78
2rlfC-4ayrA:
6.78
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.
3MNP_A_DEXA784_1
(GLUCOCORTICOID
RECEPTOR)		 4ayr MANNOSYL-OLIGOSACCHA
RIDE
1,2-ALPHA-MANNOSIDAS
E
(Caulobacter
sp.
K31) 		5 / 12 GLY A 194
MET A 213
LEU A 255
THR A 451
ILE A 124
 None
None
None
IFL  A 503 ( 3.0A)
None
 1.30A 3mnpA-4ayrA:
undetectable		 3mnpA-4ayrA:
19.69
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.
3SG9_B_KANB305_1
(APH(2'')-ID)		 4ayr MANNOSYL-OLIGOSACCHA
RIDE
1,2-ALPHA-MANNOSIDAS
E
(Caulobacter
sp.
K31) 		4 / 8 ASN A 182
SER A 308
GLU A 365
GLU A 427
 IFL  A 504 (-3.5A)
None
IFL  A 503 (-3.0A)
IFL  A 503 (-2.9A)
 1.07A 3sg9B-4ayrA:
undetectable		 3sg9B-4ayrA:
21.05
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.
3T3S_E_9PLE1_1
(CYTOCHROME P450 2A13)		 4ayr MANNOSYL-OLIGOSACCHA
RIDE
1,2-ALPHA-MANNOSIDAS
E
(Caulobacter
sp.
K31) 		4 / 8 ALA A 277
PHE A 237
PHE A 297
ALA A 242
 None
 0.96A 3t3sE-4ayrA:
undetectable		 3t3sE-4ayrA:
21.57
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.
3T3S_F_9PLF1_1
(CYTOCHROME P450 2A13)		 4ayr MANNOSYL-OLIGOSACCHA
RIDE
1,2-ALPHA-MANNOSIDAS
E
(Caulobacter
sp.
K31) 		4 / 8 ALA A 277
PHE A 237
PHE A 297
ALA A 242
 None
 0.97A 3t3sF-4ayrA:
undetectable		 3t3sF-4ayrA:
21.57
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.
3VLN_A_ASCA904_0
(GLUTATHIONE
S-TRANSFERASE
OMEGA-1)		 4ayr MANNOSYL-OLIGOSACCHA
RIDE
1,2-ALPHA-MANNOSIDAS
E
(Caulobacter
sp.
K31) 		4 / 6 ARG A 356
LEU A 310
GLU A 346
SER A 347
 None
IFL  A 503 ( 4.7A)
None
None
 1.06A 3vlnA-4ayrA:
3.2		 3vlnA-4ayrA:
21.04
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.
4EJG_D_NCTD501_1
(CYTOCHROME P450 2A13)		 4ayr MANNOSYL-OLIGOSACCHA
RIDE
1,2-ALPHA-MANNOSIDAS
E
(Caulobacter
sp.
K31) 		4 / 6 ASN A 170
ALA A 117
THR A 122
LEU A 149
 None
 1.03A 4ejgD-4ayrA:
undetectable		 4ejgD-4ayrA:
21.57
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.
4FEW_A_KANA301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)		 4ayr MANNOSYL-OLIGOSACCHA
RIDE
1,2-ALPHA-MANNOSIDAS
E
(Caulobacter
sp.
K31) 		5 / 11 GLN A 320
ASP A 249
ASP A 368
GLU A 365
ARG A 125
 CA  A 501 ( 4.2A)
IFL  A 504 (-2.8A)
CA  A 501 ( 4.8A)
IFL  A 503 (-3.0A)
IFL  A 503 ( 4.1A)
 1.29A 4fewA-4ayrA:
0.4
4fewD-4ayrA:
0.0		 4fewA-4ayrA:
21.22
4fewD-4ayrA:
21.22
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.
4GC9_A_ACTA402_0
(DIMETHYLADENOSINE
TRANSFERASE 1,
MITOCHONDRIAL)		 4ayr MANNOSYL-OLIGOSACCHA
RIDE
1,2-ALPHA-MANNOSIDAS
E
(Caulobacter
sp.
K31) 		3 / 3 LYS A 394
TYR A 403
ARG A 398
 None
 1.45A 4gc9A-4ayrA:
undetectable		 4gc9A-4ayrA:
24.49
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.
4K50_A_ACTA506_0
(RNA POLYMERASE
3D-POL)		 4ayr MANNOSYL-OLIGOSACCHA
RIDE
1,2-ALPHA-MANNOSIDAS
E
(Caulobacter
sp.
K31) 		3 / 3 VAL A  52
GLY A  50
LYS A  54
 None
 0.76A 4k50A-4ayrA:
undetectable		 4k50A-4ayrA:
22.50
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.
4K50_E_ACTE504_0
(RNA POLYMERASE
3D-POL)		 4ayr MANNOSYL-OLIGOSACCHA
RIDE
1,2-ALPHA-MANNOSIDAS
E
(Caulobacter
sp.
K31) 		3 / 3 VAL A  52
GLY A  50
LYS A  54
 None
 0.74A 4k50E-4ayrA:
undetectable		 4k50E-4ayrA:
22.50
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.
4NKV_C_AERC601_2
(STEROID
17-ALPHA-HYDROXYLASE
/17,20 LYASE)		 4ayr MANNOSYL-OLIGOSACCHA
RIDE
1,2-ALPHA-MANNOSIDAS
E
(Caulobacter
sp.
K31) 		4 / 6 TYR A 286
LEU A 337
ASP A 245
ALA A 369
 None
 0.99A 4nkvC-4ayrA:
undetectable		 4nkvC-4ayrA:
23.19
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.
4RJD_B_TFPB204_1
(CALMODULIN)		 4ayr MANNOSYL-OLIGOSACCHA
RIDE
1,2-ALPHA-MANNOSIDAS
E
(Caulobacter
sp.
K31) 		4 / 8 LEU A 362
GLY A 361
GLU A 365
ALA A 312
 None
None
IFL  A 503 (-3.0A)
None
 0.88A 4rjdA-4ayrA:
undetectable
4rjdB-4ayrA:
undetectable		 4rjdA-4ayrA:
11.48
4rjdB-4ayrA:
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.
4RTB_A_SAMA501_1
(HYDG PROTEIN)		 4ayr MANNOSYL-OLIGOSACCHA
RIDE
1,2-ALPHA-MANNOSIDAS
E
(Caulobacter
sp.
K31) 		3 / 3 GLU A 452
ARG A 125
GLN A 428
 IFL  A 503 (-3.1A)
IFL  A 503 ( 4.1A)
None
 0.91A 4rtbA-4ayrA:
undetectable		 4rtbA-4ayrA:
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.
4RYA_A_MTLA501_1
(ABC TRANSPORTER
SUBSTRATE BINDING
PROTEIN (SORBITOL))		 4ayr MANNOSYL-OLIGOSACCHA
RIDE
1,2-ALPHA-MANNOSIDAS
E
(Caulobacter
sp.
K31) 		3 / 3 GLU A 253
TYR A 431
GLU A 427
 CA  A 501 (-3.4A)
None
IFL  A 503 (-2.9A)
 0.75A 4ryaA-4ayrA:
undetectable		 4ryaA-4ayrA:
21.15
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.
5DBY_A_ACTA617_0
(SERUM ALBUMIN)		 4ayr MANNOSYL-OLIGOSACCHA
RIDE
1,2-ALPHA-MANNOSIDAS
E
(Caulobacter
sp.
K31) 		3 / 3 TRP A 270
ARG A 214
LEU A 190
 None
 0.50A 5dbyA-4ayrA:
0.9		 5dbyA-4ayrA:
21.53
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.
5H4D_A_BBIA403_1
(NAD-DEPENDENT
PROTEIN DEACETYLASE
SIRTUIN-3,
MITOCHONDRIAL)		 4ayr MANNOSYL-OLIGOSACCHA
RIDE
1,2-ALPHA-MANNOSIDAS
E
(Caulobacter
sp.
K31) 		4 / 6 PHE A  72
ARG A 125
GLU A  60
GLU A 427
 None
IFL  A 503 ( 4.1A)
None
IFL  A 503 (-2.9A)
 1.41A 5h4dA-4ayrA:
undetectable		 5h4dA-4ayrA:
20.44
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.
5IQG_A_51GA600_1
(BIFUNCTIONAL AAC/APH)		 4ayr MANNOSYL-OLIGOSACCHA
RIDE
1,2-ALPHA-MANNOSIDAS
E
(Caulobacter
sp.
K31) 		5 / 10 ASP A 249
ASP A 245
GLU A 452
GLU A 121
GLU A 309
 IFL  A 504 (-2.8A)
None
IFL  A 503 (-3.1A)
IFL  A 504 ( 4.4A)
None
 1.41A 5iqgA-4ayrA:
0.8		 5iqgA-4ayrA:
22.27
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.
5IQG_C_51GC600_1
(BIFUNCTIONAL AAC/APH)		 4ayr MANNOSYL-OLIGOSACCHA
RIDE
1,2-ALPHA-MANNOSIDAS
E
(Caulobacter
sp.
K31) 		5 / 10 ASP A 245
GLU A 452
GLU A 121
GLU A 427
GLU A 309
 None
IFL  A 503 (-3.1A)
IFL  A 504 ( 4.4A)
IFL  A 503 (-2.9A)
None
 1.46A 5iqgC-4ayrA:
0.0		 5iqgC-4ayrA:
22.27
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.
5IQG_C_51GC600_1
(BIFUNCTIONAL AAC/APH)		 4ayr MANNOSYL-OLIGOSACCHA
RIDE
1,2-ALPHA-MANNOSIDAS
E
(Caulobacter
sp.
K31) 		5 / 10 ASP A 249
ASP A 245
GLU A 452
GLU A 121
GLU A 309
 IFL  A 504 (-2.8A)
None
IFL  A 503 (-3.1A)
IFL  A 504 ( 4.4A)
None
 1.36A 5iqgC-4ayrA:
0.0		 5iqgC-4ayrA:
22.27
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.
5L1F_A_6ZPA902_1
(GLUTAMATE RECEPTOR 2)		 4ayr MANNOSYL-OLIGOSACCHA
RIDE
1,2-ALPHA-MANNOSIDAS
E
(Caulobacter
sp.
K31) 		4 / 8 SER A 243
ASP A 245
ASN A 241
SER A 347
 None
 1.09A 5l1fA-4ayrA:
undetectable
5l1fB-4ayrA:
undetectable		 5l1fA-4ayrA:
19.45
5l1fB-4ayrA:
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.
6FGC_A_ACTA810_0
(GEPHYRIN)		 4ayr MANNOSYL-OLIGOSACCHA
RIDE
1,2-ALPHA-MANNOSIDAS
E
(Caulobacter
sp.
K31) 		3 / 3 LEU A  80
SER A  70
PHE A  71
 None
 0.57A 6fgcA-4ayrA:
undetectable		 6fgcA-4ayrA:
22.59