SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3r1x'

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.
1DB1_A_VDXA428_2
(VITAMIN D NUCLEAR
RECEPTOR)		 3r1x 2-OXO-3-DEOXYGALACTO
NATE KINASE
(Klebsiella
pneumoniae) 		4 / 6 LEU A 228
ILE A 266
ARG A 268
TYR A 259
 None
 1.05A 1db1A-3r1xA:
undetectable		 1db1A-3r1xA:
20.39
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.
1N13_B_AG2B7011_1
(PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE ALPHA
CHAIN
PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE BETA
CHAIN)		 3r1x 2-OXO-3-DEOXYGALACTO
NATE KINASE
(Klebsiella
pneumoniae) 		4 / 5 ARG A 109
LEU A 146
ASP A 154
LEU A  81
 FMT  A 294 ( 4.6A)
None
FMT  A 294 (-3.4A)
None
 1.23A 1n13B-3r1xA:
undetectable
1n13C-3r1xA:
undetectable		 1n13B-3r1xA:
15.10
1n13C-3r1xA:
12.07
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.
1N4F_A_ASRA141_0
(LYSOZYME C)		 3r1x 2-OXO-3-DEOXYGALACTO
NATE KINASE
(Klebsiella
pneumoniae) 		4 / 6 ASP A  56
GLY A  57
THR A  59
PRO A  60
 None
 0.71A 1n4fA-3r1xA:
undetectable		 1n4fA-3r1xA:
16.49
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.
1P2Y_A_NCTA440_1
(CYTOCHROME P450-CAM)		 3r1x 2-OXO-3-DEOXYGALACTO
NATE KINASE
(Klebsiella
pneumoniae) 		4 / 7 VAL A  67
GLY A  68
ILE A  99
VAL A  95
 None
 0.74A 1p2yA-3r1xA:
undetectable		 1p2yA-3r1xA:
22.57
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.
1P6K_B_ACTB861_0
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 3r1x 2-OXO-3-DEOXYGALACTO
NATE KINASE
(Klebsiella
pneumoniae) 		4 / 5 GLY A  65
TRP A  10
VAL A  35
SER A  69
 None
 1.36A 1p6kB-3r1xA:
undetectable		 1p6kB-3r1xA:
20.73
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.
1RS6_B_ACTB861_0
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 3r1x 2-OXO-3-DEOXYGALACTO
NATE KINASE
(Klebsiella
pneumoniae) 		4 / 5 GLY A  65
TRP A  10
VAL A  35
SER A  69
 None
 1.35A 1rs6B-3r1xA:
undetectable		 1rs6B-3r1xA:
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.
1RS7_A_ACTA860_0
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 3r1x 2-OXO-3-DEOXYGALACTO
NATE KINASE
(Klebsiella
pneumoniae) 		4 / 5 GLY A  65
ILE A 101
TRP A  10
VAL A  35
 None
 1.11A 1rs7A-3r1xA:
undetectable		 1rs7A-3r1xA:
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.
1RS7_B_ACTB861_0
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 3r1x 2-OXO-3-DEOXYGALACTO
NATE KINASE
(Klebsiella
pneumoniae) 		4 / 6 GLY A  65
ILE A 101
TRP A  10
VAL A  35
 None
 1.10A 1rs7B-3r1xA:
undetectable		 1rs7B-3r1xA:
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.
1XL6_B_SPMB3001_1
(INWARD RECTIFIER
POTASSIUM CHANNEL)		 3r1x 2-OXO-3-DEOXYGALACTO
NATE KINASE
(Klebsiella
pneumoniae) 		4 / 5 ALA A   0
ALA A 291
TYR A   5
GLN A 280
 None
 1.12A 1xl6A-3r1xA:
undetectable
1xl6B-3r1xA:
undetectable		 1xl6A-3r1xA:
22.87
1xl6B-3r1xA:
22.87
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.
1ZZQ_A_ACTA860_0
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 3r1x 2-OXO-3-DEOXYGALACTO
NATE KINASE
(Klebsiella
pneumoniae) 		4 / 4 GLY A  65
TRP A  10
VAL A  35
SER A  69
 None
 1.34A 1zzqA-3r1xA:
0.0		 1zzqA-3r1xA:
20.99
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.
1ZZQ_B_ACTB861_0
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 3r1x 2-OXO-3-DEOXYGALACTO
NATE KINASE
(Klebsiella
pneumoniae) 		4 / 5 GLY A  65
TRP A  10
VAL A  35
SER A  69
 None
 1.28A 1zzqB-3r1xA:
undetectable		 1zzqB-3r1xA:
20.99
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.
1ZZU_A_ACTA860_0
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 3r1x 2-OXO-3-DEOXYGALACTO
NATE KINASE
(Klebsiella
pneumoniae) 		4 / 5 GLY A  65
TRP A  10
VAL A  35
SER A  69
 None
 1.32A 1zzuA-3r1xA:
2.2		 1zzuA-3r1xA:
20.99
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.
1ZZU_B_ACTB861_0
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 3r1x 2-OXO-3-DEOXYGALACTO
NATE KINASE
(Klebsiella
pneumoniae) 		4 / 5 GLY A  65
TRP A  10
VAL A  35
SER A  69
 None
 1.37A 1zzuB-3r1xA:
undetectable		 1zzuB-3r1xA:
20.99
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.
3N62_A_ACTA860_0
(NITRIC OXIDE
SYNTHASE)		 3r1x 2-OXO-3-DEOXYGALACTO
NATE KINASE
(Klebsiella
pneumoniae) 		4 / 4 GLY A  65
TRP A  10
VAL A  35
SER A  69
 None
 1.37A 3n62A-3r1xA:
1.9		 3n62A-3r1xA:
20.99
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.
3N65_A_ACTA860_0
(NITRIC OXIDE
SYNTHASE)		 3r1x 2-OXO-3-DEOXYGALACTO
NATE KINASE
(Klebsiella
pneumoniae) 		4 / 4 GLY A  65
TRP A  10
VAL A  35
SER A  69
 None
 1.34A 3n65A-3r1xA:
2.4		 3n65A-3r1xA:
21.20
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.
3N66_A_ACTA860_0
(NITRIC OXIDE
SYNTHASE)		 3r1x 2-OXO-3-DEOXYGALACTO
NATE KINASE
(Klebsiella
pneumoniae) 		4 / 4 GLY A  65
TRP A  10
VAL A  35
SER A  69
 None
 1.38A 3n66A-3r1xA:
0.1		 3n66A-3r1xA:
21.20
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.
3UA5_B_06XB501_1
(CYTOCHROME P450 2B6)		 3r1x 2-OXO-3-DEOXYGALACTO
NATE KINASE
(Klebsiella
pneumoniae) 		4 / 7 ILE A  99
ILE A   6
GLU A  49
LEU A  15
 None
 0.68A 3ua5B-3r1xA:
undetectable		 3ua5B-3r1xA:
21.69
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.
4D33_A_ACTA860_0
(NITRIC OXIDE
SYNTHASE,
ENDOTHELIAL)		 3r1x 2-OXO-3-DEOXYGALACTO
NATE KINASE
(Klebsiella
pneumoniae) 		4 / 5 GLY A  65
ILE A 101
TRP A  10
VAL A  35
 None
 1.17A 4d33A-3r1xA:
undetectable		 4d33A-3r1xA:
21.35
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.
4D33_A_ACTA860_0
(NITRIC OXIDE
SYNTHASE,
ENDOTHELIAL)		 3r1x 2-OXO-3-DEOXYGALACTO
NATE KINASE
(Klebsiella
pneumoniae) 		4 / 5 GLY A  65
TRP A  10
VAL A  35
SER A  69
 None
 1.27A 4d33A-3r1xA:
undetectable		 4d33A-3r1xA:
21.35
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.
4D39_A_ACTA860_0
(NITRIC OXIDE
SYNTHASE,
ENDOTHELIAL)		 3r1x 2-OXO-3-DEOXYGALACTO
NATE KINASE
(Klebsiella
pneumoniae) 		4 / 4 GLY A  65
TRP A  10
VAL A  35
SER A  69
 None
 1.32A 4d39A-3r1xA:
0.0		 4d39A-3r1xA:
21.35
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.
4PST_A_FOLA201_1
(DIHYDROFOLATE
REDUCTASE)		 3r1x 2-OXO-3-DEOXYGALACTO
NATE KINASE
(Klebsiella
pneumoniae) 		3 / 3 ILE A   6
ASP A  56
ARG A  29
 None
 0.50A 4pstA-3r1xA:
undetectable		 4pstA-3r1xA:
19.93
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.
4V2O_B_CLQB1079_0
(SAPOSIN-B)		 3r1x 2-OXO-3-DEOXYGALACTO
NATE KINASE
(Klebsiella
pneumoniae) 		3 / 3 MET A 116
GLU A 119
LEU A 123
 None
 0.81A 4v2oB-3r1xA:
undetectable		 4v2oB-3r1xA:
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.
4YBN_A_ACTA303_0
(FLAVIN-NUCLEOTIDE-BI
NDING PROTEIN)		 3r1x 2-OXO-3-DEOXYGALACTO
NATE KINASE
(Klebsiella
pneumoniae) 		3 / 3 VAL A 234
TYR A 259
ALA A 262
 None
 0.52A 4ybnA-3r1xA:
undetectable		 4ybnA-3r1xA:
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.
5KOX_A_RFPA502_1
(PENTACHLOROPHENOL
4-MONOOXYGENASE)		 3r1x 2-OXO-3-DEOXYGALACTO
NATE KINASE
(Klebsiella
pneumoniae) 		5 / 12 GLY A  68
ARG A  41
GLY A  40
THR A  13
GLY A  11
 None
 0.87A 5koxA-3r1xA:
undetectable		 5koxA-3r1xA:
22.22
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.
5VUN_A_ACTA804_0
(NITRIC OXIDE
SYNTHASE, BRAIN)		 3r1x 2-OXO-3-DEOXYGALACTO
NATE KINASE
(Klebsiella
pneumoniae) 		4 / 5 GLY A  65
TRP A  10
VAL A  35
SER A  69
 None
 1.33A 5vunA-3r1xA:
undetectable		 5vunA-3r1xA:
21.20
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.
5WWS_B_SAMB501_0
(PUTATIVE
METHYLTRANSFERASE
NSUN6)		 3r1x 2-OXO-3-DEOXYGALACTO
NATE KINASE
(Klebsiella
pneumoniae) 		5 / 12 ALA A  76
PRO A  77
ILE A 102
ASP A   9
GLY A  11
 None
 1.17A 5wwsB-3r1xA:
undetectable		 5wwsB-3r1xA:
21.56
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.
5YK2_A_ERYA501_0
(PROBABLE CONSERVED
ATP-BINDING PROTEIN
ABC TRANSPORTER)		 3r1x 2-OXO-3-DEOXYGALACTO
NATE KINASE
(Klebsiella
pneumoniae) 		5 / 11 GLY A 275
ASP A 276
ALA A 274
ALA A 251
PRO A 138
 None
 1.16A 5yk2A-3r1xA:
undetectable		 5yk2A-3r1xA:
21.85
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.
6DJ1_B_AB1B201_1
(HIV-1 PROTEASE)		 3r1x 2-OXO-3-DEOXYGALACTO
NATE KINASE
(Klebsiella
pneumoniae) 		6 / 12 GLY A 118
ALA A  64
ASP A   9
VAL A  62
ILE A 283
GLY A 282
 None
 1.33A 6dj1B-3r1xA:
undetectable		 6dj1B-3r1xA:
13.57