SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4ywj'

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.
1NW3_A_SAMA500_0
(HISTONE
METHYLTRANSFERASE
DOT1L)		 4ywj 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
REDUCTASE
(Pseudomonas
aeruginosa) 		5 / 12 ASP A  75
VAL A   7
ALA A 114
PHE A 122
PHE A 103
 None
NAD  A 300 (-4.9A)
None
None
None
 1.21A 1nw3A-4ywjA:
3.6		 1nw3A-4ywjA:
21.09
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.
2BL9_A_CP6A1240_1
(DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 4ywj 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
REDUCTASE
(Pseudomonas
aeruginosa) 		5 / 12 ILE A   4
ALA A  32
LEU A  63
ILE A  74
THR A  31
 None
 1.03A 2bl9A-4ywjA:
undetectable		 2bl9A-4ywjA:
20.85
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.
2E5D_A_NCAA1501_0
(NICOTINAMIDE
PHOSPHORIBOSYLTRANSF
ERASE)		 4ywj 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
REDUCTASE
(Pseudomonas
aeruginosa) 		4 / 7 PHE A  70
ARG A   3
ALA A  92
ASP A  71
 None
 1.04A 2e5dA-4ywjA:
undetectable
2e5dB-4ywjA:
undetectable		 2e5dA-4ywjA:
19.39
2e5dB-4ywjA:
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.
2E5D_B_NCAB1502_0
(NICOTINAMIDE
PHOSPHORIBOSYLTRANSF
ERASE)		 4ywj 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
REDUCTASE
(Pseudomonas
aeruginosa) 		4 / 7 ASP A  71
PHE A  70
ARG A   3
ALA A  92
 None
 1.06A 2e5dA-4ywjA:
undetectable
2e5dB-4ywjA:
undetectable		 2e5dA-4ywjA:
19.39
2e5dB-4ywjA:
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.
2VAV_F_CSCF1383_2
(ACETYL-COA--DEACETYL
CEPHALOSPORIN C
ACETYLTRANSFERASE)		 4ywj 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
REDUCTASE
(Pseudomonas
aeruginosa) 		3 / 3 LEU A  73
MET A  96
MET A   1
 None
 0.80A 2vavF-4ywjA:
4.0		 2vavF-4ywjA:
20.70
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.
3K9W_A_ACTA170_0
(PHOSPHOPANTETHEINE
ADENYLYLTRANSFERASE)		 4ywj 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
REDUCTASE
(Pseudomonas
aeruginosa) 		3 / 3 SER A 165
GLY A 166
THR A 167
 None
 0.12A 3k9wA-4ywjA:
3.2		 3k9wA-4ywjA:
24.38
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.
3NVC_A_SALA370_1
(GENTISATE
1,2-DIOXYGENASE)		 4ywj 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
REDUCTASE
(Pseudomonas
aeruginosa) 		4 / 6 HIS A 217
ARG A 209
HIS A 156
ASP A 162
 None
 1.14A 3nvcA-4ywjA:
undetectable		 3nvcA-4ywjA:
21.98
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.
3TQ8_A_TOPA2001_1
(DIHYDROFOLATE
REDUCTASE)		 4ywj 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
REDUCTASE
(Pseudomonas
aeruginosa) 		5 / 9 ILE A   4
ALA A  32
LEU A  63
ILE A  74
THR A  31
 None
 1.13A 3tq8A-4ywjA:
undetectable		 3tq8A-4ywjA:
23.47
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.
4DQH_B_017B101_1
(WILD-TYPE HIV-1
PROTEASE DIMER)		 4ywj 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
REDUCTASE
(Pseudomonas
aeruginosa) 		5 / 11 LEU A  30
ALA A  28
VAL A  72
VAL A   6
ILE A   4
 None
 0.95A 4dqhA-4ywjA:
undetectable		 4dqhA-4ywjA:
20.35
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.
4G8Z_X_TOPX301_1
(DIHYDROFOLATE
REDUCTASE)		 4ywj 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
REDUCTASE
(Pseudomonas
aeruginosa) 		5 / 10 ILE A   4
ALA A  32
LEU A  63
ILE A  74
THR A  31
 None
 1.14A 4g8zX-4ywjA:
undetectable		 4g8zX-4ywjA:
22.61
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.
5EB3_A_UEGA202_1
(YFIR)		 4ywj 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
REDUCTASE
(Pseudomonas
aeruginosa) 		4 / 4 LEU A 111
ILE A  98
PRO A  79
LEU A  83
 None
 1.21A 5eb3A-4ywjA:
4.5		 5eb3A-4ywjA:
20.07
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.
5ECK_A_ILEA601_0
(JASMONIC ACID-AMIDO
SYNTHETASE JAR1)		 4ywj 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
REDUCTASE
(Pseudomonas
aeruginosa) 		4 / 6 ALA A  32
THR A  31
VAL A  57
VAL A  21
 None
 1.00A 5eckA-4ywjA:
undetectable		 5eckA-4ywjA:
19.00
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.
5ECK_D_ILED601_0
(JASMONIC ACID-AMIDO
SYNTHETASE JAR1)		 4ywj 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
REDUCTASE
(Pseudomonas
aeruginosa) 		4 / 6 ALA A  32
THR A  31
VAL A  57
VAL A  21
 None
 0.99A 5eckD-4ywjA:
undetectable		 5eckD-4ywjA:
19.00
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.
5YF0_A_SAMA505_1
(CARNOSINE
N-METHYLTRANSFERASE)		 4ywj 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
REDUCTASE
(Pseudomonas
aeruginosa) 		4 / 5 GLN A 184
TYR A 189
GLU A 173
ASP A 138
 None
 1.34A 5yf0A-4ywjA:
5.2		 5yf0A-4ywjA:
19.35