SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '2qvx'

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.
1XMU_A_ROFA101_1
(CAMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE 4B)		 2qvx 4-CHLOROBENZOATE COA
LIGASE
(Alcaligenes
sp.
AL3007) 		4 / 5 ASN X   5
THR X   3
MET X   1
GLN X 175
 None
 1.50A 1xmuA-2qvxX:
0.2		 1xmuA-2qvxX:
20.04
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.
1ZLQ_A_ACTA1507_0
(NICKEL-BINDING
PERIPLASMIC PROTEIN)		 2qvx 4-CHLOROBENZOATE COA
LIGASE
(Alcaligenes
sp.
AL3007) 		3 / 3 GLN X 175
HIS X  75
ARG X  76
 None
 0.96A 1zlqA-2qvxX:
undetectable		 1zlqA-2qvxX:
22.82
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.
2OZ7_A_CA4A1_1
(ANDROGEN RECEPTOR)		 2qvx 4-CHLOROBENZOATE COA
LIGASE
(Alcaligenes
sp.
AL3007) 		5 / 12 LEU X  74
LEU X  77
GLY X  78
ALA X  82
LEU X  83
 None
 1.17A 2oz7A-2qvxX:
undetectable		 2oz7A-2qvxX:
18.13
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.
2QHF_A_ACTA503_0
(CHORISMATE SYNTHASE)		 2qvx 4-CHLOROBENZOATE COA
LIGASE
(Alcaligenes
sp.
AL3007) 		4 / 5 GLN X   2
ARG X  10
ALA X  11
ARG X  14
 None
 1.18A 2qhfA-2qvxX:
undetectable		 2qhfA-2qvxX:
24.50
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.
2QHF_A_ACTA508_0
(CHORISMATE SYNTHASE)		 2qvx 4-CHLOROBENZOATE COA
LIGASE
(Alcaligenes
sp.
AL3007) 		4 / 5 LEU X  21
ARG X  38
ALA X  20
ILE X  69
 None
 1.05A 2qhfA-2qvxX:
undetectable		 2qhfA-2qvxX:
24.50
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.
3BJW_B_SVRB512_1
(PHOSPHOLIPASE A2)		 2qvx 4-CHLOROBENZOATE COA
LIGASE
(Alcaligenes
sp.
AL3007) 		4 / 5 VAL X 209
VAL X 208
THR X 251
ARG X 181
 3BZ  X 505 (-4.9A)
None
None
None
 1.10A 3bjwA-2qvxX:
undetectable		 3bjwA-2qvxX:
13.15
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.
3BJW_F_SVRF509_1
(PHOSPHOLIPASE A2)		 2qvx 4-CHLOROBENZOATE COA
LIGASE
(Alcaligenes
sp.
AL3007) 		4 / 5 VAL X 209
VAL X 208
THR X 251
ARG X 181
 3BZ  X 505 (-4.9A)
None
None
None
 1.13A 3bjwC-2qvxX:
undetectable		 3bjwC-2qvxX:
13.15
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.
3FPJ_B_SAMB301_0
(PUTATIVE
UNCHARACTERIZED
PROTEIN)		 2qvx 4-CHLOROBENZOATE COA
LIGASE
(Alcaligenes
sp.
AL3007) 		5 / 12 ILE X 433
VAL X 432
GLU X 429
LEU X 494
VAL X 502
 None
 1.20A 3fpjB-2qvxX:
4.5		 3fpjB-2qvxX:
18.54
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.
3LP9_D_SPMD230_1
(LS-24)		 2qvx 4-CHLOROBENZOATE COA
LIGASE
(Alcaligenes
sp.
AL3007) 		3 / 3 GLU X  40
GLU X   6
ASN X   5
 None
 0.66A 3lp9B-2qvxX:
undetectable
3lp9D-2qvxX:
undetectable		 3lp9B-2qvxX:
16.33
3lp9D-2qvxX:
16.33
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.
3OGP_A_017A200_2
(FIV PROTEASE)		 2qvx 4-CHLOROBENZOATE COA
LIGASE
(Alcaligenes
sp.
AL3007) 		5 / 10 LEU X 200
ALA X 250
VAL X 277
VAL X 245
LEU X 248
 None
 1.08A 3ogpB-2qvxX:
undetectable		 3ogpB-2qvxX:
10.60
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.
4BZ6_B_SHHB700_1
(HISTONE DEACETYLASE
8)		 2qvx 4-CHLOROBENZOATE COA
LIGASE
(Alcaligenes
sp.
AL3007) 		5 / 12 ASP X 235
HIS X 254
PHE X 231
PRO X  24
GLY X 201
 None
 1.31A 4bz6A-2qvxX:
undetectable
4bz6B-2qvxX:
undetectable		 4bz6A-2qvxX:
22.06
4bz6B-2qvxX:
22.06
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.
4J6D_A_TESA503_1
(CYTOCHROME P450
MONOOXYGENASE)		 2qvx 4-CHLOROBENZOATE COA
LIGASE
(Alcaligenes
sp.
AL3007) 		5 / 12 ALA X 259
ALA X 261
ALA X 262
VAL X 240
LEU X 248
 None
 1.05A 4j6dA-2qvxX:
undetectable		 4j6dA-2qvxX:
23.48
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.
4J6D_B_TESB502_1
(CYTOCHROME P450
MONOOXYGENASE)		 2qvx 4-CHLOROBENZOATE COA
LIGASE
(Alcaligenes
sp.
AL3007) 		5 / 12 ALA X 259
ALA X 261
ALA X 262
VAL X 240
LEU X 248
 None
 1.05A 4j6dB-2qvxX:
undetectable		 4j6dB-2qvxX:
23.48
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.
4J7X_B_SASB804_1
(SEPIAPTERIN
REDUCTASE)		 2qvx 4-CHLOROBENZOATE COA
LIGASE
(Alcaligenes
sp.
AL3007) 		5 / 12 LEU X 248
ALA X 217
MET X 185
GLY X 190
LEU X 191
 None
 1.23A 4j7xB-2qvxX:
undetectable		 4j7xB-2qvxX:
20.90
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.
4JBT_A_ASDA501_1
(CYTOCHROME P450
MONOOXYGENASE)		 2qvx 4-CHLOROBENZOATE COA
LIGASE
(Alcaligenes
sp.
AL3007) 		5 / 12 ALA X 259
ALA X 261
ALA X 262
VAL X 240
LEU X 248
 None
 1.02A 4jbtA-2qvxX:
undetectable		 4jbtA-2qvxX:
23.48
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.
4JBT_B_ASDB502_1
(CYTOCHROME P450
MONOOXYGENASE)		 2qvx 4-CHLOROBENZOATE COA
LIGASE
(Alcaligenes
sp.
AL3007) 		5 / 11 ALA X 259
ALA X 261
ALA X 262
VAL X 240
LEU X 248
 None
 1.05A 4jbtB-2qvxX:
undetectable		 4jbtB-2qvxX:
23.48
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.
4K6I_A_9RAA500_1
(RETINOIC ACID
RECEPTOR RXR-ALPHA)		 2qvx 4-CHLOROBENZOATE COA
LIGASE
(Alcaligenes
sp.
AL3007) 		5 / 12 ILE X  71
PHE X 157
LEU X  83
ALA X  82
VAL X   4
 None
 0.95A 4k6iA-2qvxX:
undetectable		 4k6iA-2qvxX:
19.04
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.
5HGC_A_HCYA501_1
(SERPIN)		 2qvx 4-CHLOROBENZOATE COA
LIGASE
(Alcaligenes
sp.
AL3007) 		5 / 12 VAL X 432
ALA X 446
THR X 423
PHE X 464
SER X 468
 None
 1.28A 5hgcA-2qvxX:
undetectable		 5hgcA-2qvxX:
20.49
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.
5N5D_B_SAMB303_0
(METHYLTRANSFERASE)		 2qvx 4-CHLOROBENZOATE COA
LIGASE
(Alcaligenes
sp.
AL3007) 		5 / 12 ALA X  70
VAL X  67
ILE X  97
ALA X  82
TYR X 160
 None
 1.08A 5n5dB-2qvxX:
undetectable		 5n5dB-2qvxX:
20.04
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.
5NUK_A_Z80A201_1
(BETA-LACTOGLOBULIN)		 2qvx 4-CHLOROBENZOATE COA
LIGASE
(Alcaligenes
sp.
AL3007) 		5 / 10 ALA X 213
PHE X 157
ILE X 173
VAL X   4
ALA X 217
 None
 1.00A 5nukA-2qvxX:
undetectable		 5nukA-2qvxX:
9.41
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.
5O96_E_SAME501_0
(RIBOSOMAL RNA SMALL
SUBUNIT
METHYLTRANSFERASE E)		 2qvx 4-CHLOROBENZOATE COA
LIGASE
(Alcaligenes
sp.
AL3007) 		5 / 9 LEU X 274
HIS X 276
SER X 273
VAL X 199
LEU X 200
 None
 1.45A 5o96E-2qvxX:
undetectable
5o96F-2qvxX:
undetectable		 5o96E-2qvxX:
19.24
5o96F-2qvxX:
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.
5TWJ_D_SAMD201_0
(RIBOSOMAL RNA LARGE
SUBUNIT
METHYLTRANSFERASE H)		 2qvx 4-CHLOROBENZOATE COA
LIGASE
(Alcaligenes
sp.
AL3007) 		6 / 11 LEU X 353
ASP X 385
ILE X 334
LEU X 313
THR X 322
VAL X 395
 None
 1.26A 5twjD-2qvxX:
undetectable		 5twjD-2qvxX:
17.38
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.
6E5Z_A_CCSA106_0
(PROTEIN/NUCLEIC ACID
DEGLYCASE DJ-1)		 2qvx 4-CHLOROBENZOATE COA
LIGASE
(Alcaligenes
sp.
AL3007) 		5 / 10 GLY X 303
ALA X 280
PRO X 252
THR X 283
GLY X 321
 3BZ  X 505 ( 3.9A)
3BZ  X 505 (-3.5A)
None
None
None
 1.14A 6e5zA-2qvxX:
2.5		 6e5zA-2qvxX:
16.67
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.
6ELI_A_T27A701_1
(REVERSE
TRANSCRIPTASE)		 2qvx 4-CHLOROBENZOATE COA
LIGASE
(Alcaligenes
sp.
AL3007) 		5 / 12 LEU X  30
VAL X 227
VAL X  68
PRO X  24
LEU X  28
 None
 1.29A 6eliA-2qvxX:
undetectable		 6eliA-2qvxX:
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.
6F6J_D_ACTD404_0
(L-LYSINE
3-HYDROXYLASE)		 2qvx 4-CHLOROBENZOATE COA
LIGASE
(Alcaligenes
sp.
AL3007) 		4 / 6 GLN X  54
HIS X  75
ALA X 156
GLN X 154
 None
 1.21A 6f6jC-2qvxX:
undetectable
6f6jD-2qvxX:
undetectable		 6f6jC-2qvxX:
24.00
6f6jD-2qvxX:
24.00