SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3si9'

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.
1DVX_B_DIFB125_2
(TRANSTHYRETIN)		 3si9 DIHYDRODIPICOLINATE
SYNTHASE
(Bartonella
henselae) 		4 / 7 LEU A 264
ALA A 260
LEU A 266
VAL A 248
 None
 0.80A 1dvxB-3si9A:
undetectable		 1dvxB-3si9A:
18.71
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.
1FO4_B_SALB4005_1
(XANTHINE
DEHYDROGENASE)		 3si9 DIHYDRODIPICOLINATE
SYNTHASE
(Bartonella
henselae) 		4 / 7 SER A 143
THR A 108
VAL A 107
ALA A 168
 None
 1.10A 1fo4B-3si9A:
undetectable		 1fo4B-3si9A:
13.38
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.
1NSI_C_H4BC602_1
(PROTEIN (NITRIC
OXIDE SYNTHASE))		 3si9 DIHYDRODIPICOLINATE
SYNTHASE
(Bartonella
henselae) 		4 / 6 ARG A 272
ILE A  63
PHE A  17
GLU A  25
 None
 1.27A 1nsiC-3si9A:
undetectable
1nsiD-3si9A:
undetectable		 1nsiC-3si9A:
23.15
1nsiD-3si9A:
23.15
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.
1SDV_B_MK1B902_2
(PROTEASE RETROPEPSIN)		 3si9 DIHYDRODIPICOLINATE
SYNTHASE
(Bartonella
henselae) 		5 / 11 GLY A  80
ALA A  79
VAL A  68
ILE A 130
ILE A  64
 None
 0.80A 1sdvB-3si9A:
undetectable		 1sdvB-3si9A:
12.89
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.
1SN5_C_T3C601_1
(TRANSTHYRETIN)		 3si9 DIHYDRODIPICOLINATE
SYNTHASE
(Bartonella
henselae) 		4 / 6 LEU A 264
ALA A 260
LEU A 266
VAL A 248
 None
 0.83A 1sn5A-3si9A:
undetectable		 1sn5A-3si9A:
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.
1SN5_C_T3C601_2
(TRANSTHYRETIN)		 3si9 DIHYDRODIPICOLINATE
SYNTHASE
(Bartonella
henselae) 		4 / 8 LEU A 264
ALA A 260
LEU A 266
VAL A 248
 None
 0.86A 1sn5C-3si9A:
undetectable		 1sn5C-3si9A:
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.
1TYR_B_9CRB130_1
(TRANSTHYRETIN)		 3si9 DIHYDRODIPICOLINATE
SYNTHASE
(Bartonella
henselae) 		4 / 7 LEU A 264
ALA A 260
LEU A 266
VAL A 248
 None
 0.80A 1tyrB-3si9A:
undetectable		 1tyrB-3si9A:
19.05
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.
2BR4_E_SAME301_1
(CEPHALOSPORIN
HYDROXYLASE CMCI)		 3si9 DIHYDRODIPICOLINATE
SYNTHASE
(Bartonella
henselae) 		3 / 3 SER A 253
ASP A 192
CYH A 207
 None
 1.18A 2br4E-3si9A:
undetectable		 2br4E-3si9A:
19.38
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.
2CDQ_A_SAMA1500_0
(ASPARTOKINASE)		 3si9 DIHYDRODIPICOLINATE
SYNTHASE
(Bartonella
henselae) 		4 / 8 ILE A  63
ARG A 272
LEU A  55
GLU A  59
 None
 0.90A 2cdqA-3si9A:
undetectable		 2cdqA-3si9A:
20.08
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.
2F8L_A_SAMA400_0
(HYPOTHETICAL PROTEIN
LMO1582)		 3si9 DIHYDRODIPICOLINATE
SYNTHASE
(Bartonella
henselae) 		5 / 12 ALA A  96
GLY A 100
VAL A  78
ASP A 102
GLY A  80
 None
 1.10A 2f8lA-3si9A:
undetectable		 2f8lA-3si9A:
24.26
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.
2FK8_A_SAMA302_1
(METHOXY MYCOLIC ACID
SYNTHASE 4)		 3si9 DIHYDRODIPICOLINATE
SYNTHASE
(Bartonella
henselae) 		3 / 3 SER A 143
THR A 151
GLN A 116
 None
EDO  A 803 ( 4.0A)
None
 0.78A 2fk8A-3si9A:
undetectable		 2fk8A-3si9A:
23.12
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.
3CL9_A_MTXA602_1
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE (DHFR-TS))		 3si9 DIHYDRODIPICOLINATE
SYNTHASE
(Bartonella
henselae) 		5 / 12 ALA A 196
ILE A 172
SER A 176
PHE A 186
TYR A 231
 None
 1.25A 3cl9A-3si9A:
undetectable		 3cl9A-3si9A:
21.00
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.
3KM6_A_EAAA222_1
(GLUTATHIONE
S-TRANSFERASE P)		 3si9 DIHYDRODIPICOLINATE
SYNTHASE
(Bartonella
henselae) 		5 / 10 VAL A  10
GLY A  42
GLN A 188
ASN A  41
GLY A   8
 None
 1.23A 3km6A-3si9A:
undetectable		 3km6A-3si9A:
21.71
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.
3KMO_A_EAAA214_1
(GLUTATHIONE
S-TRANSFERASE P)		 3si9 DIHYDRODIPICOLINATE
SYNTHASE
(Bartonella
henselae) 		5 / 9 VAL A  10
GLY A  42
GLN A 188
ASN A  41
GLY A   8
 None
 1.29A 3kmoA-3si9A:
undetectable		 3kmoA-3si9A:
21.71
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.
3NUJ_B_478B401_2
(PROTEASE)		 3si9 DIHYDRODIPICOLINATE
SYNTHASE
(Bartonella
henselae) 		5 / 9 GLY A  80
ALA A  79
VAL A  68
ILE A 130
ILE A  64
 None
 0.92A 3nujB-3si9A:
undetectable		 3nujB-3si9A:
16.30
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.
3NUO_B_478B478_2
(PROTEASE)		 3si9 DIHYDRODIPICOLINATE
SYNTHASE
(Bartonella
henselae) 		5 / 9 GLY A  80
ALA A  79
VAL A  68
ILE A 130
ILE A  64
 None
 0.94A 3nuoB-3si9A:
undetectable		 3nuoB-3si9A:
16.30
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.
3OZK_B_T44B128_1
(TRANSTHYRETIN)		 3si9 DIHYDRODIPICOLINATE
SYNTHASE
(Bartonella
henselae) 		4 / 7 LEU A 264
ALA A 260
LEU A 266
VAL A 248
 None
 0.79A 3ozkB-3si9A:
undetectable		 3ozkB-3si9A:
19.37
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.
3UT5_D_LOCD502_1
(TUBULIN BETA CHAIN)		 3si9 DIHYDRODIPICOLINATE
SYNTHASE
(Bartonella
henselae) 		5 / 12 ALA A 293
LEU A 244
ALA A 260
LYS A 263
ILE A 257
 None
 1.06A 3ut5D-3si9A:
2.8		 3ut5D-3si9A:
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.
3V8V_A_SAMA801_0
(RIBOSOMAL RNA LARGE
SUBUNIT
METHYLTRANSFERASE L)		 3si9 DIHYDRODIPICOLINATE
SYNTHASE
(Bartonella
henselae) 		5 / 12 ILE A  40
SER A 209
THR A  11
VAL A 187
ASN A  41
 None
None
None
EDO  A 801 (-3.7A)
None
 1.11A 3v8vA-3si9A:
undetectable		 3v8vA-3si9A:
17.76
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.
4IK7_B_IMNB201_1
(TRANSTHYRETIN)		 3si9 DIHYDRODIPICOLINATE
SYNTHASE
(Bartonella
henselae) 		4 / 8 LEU A 264
ALA A 260
LEU A 266
VAL A 248
 None
 0.82A 4ik7B-3si9A:
undetectable		 4ik7B-3si9A:
19.05
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.
4O2B_B_LOCB503_2
(TUBULIN BETA-2B
CHAIN)		 3si9 DIHYDRODIPICOLINATE
SYNTHASE
(Bartonella
henselae) 		5 / 12 ALA A 293
LEU A 244
ALA A 260
LYS A 263
ILE A 257
 None
 1.01A 4o2bB-3si9A:
3.3		 4o2bB-3si9A:
20.66
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.
4O2B_D_LOCD503_2
(TUBULIN BETA-2B
CHAIN)		 3si9 DIHYDRODIPICOLINATE
SYNTHASE
(Bartonella
henselae) 		5 / 12 ALA A 293
LEU A 244
ALA A 260
LYS A 263
ILE A 257
 None
 0.95A 4o2bD-3si9A:
undetectable		 4o2bD-3si9A:
20.66
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.
4YPE_A_SAMA2304_0
(HISTONE-LYSINE
N-METHYLTRANSFERASE
ASH1L)		 3si9 DIHYDRODIPICOLINATE
SYNTHASE
(Bartonella
henselae) 		5 / 12 GLY A 206
ASP A 192
ASN A 200
HIS A 202
ILE A 172
 None
 1.50A 4ypeA-3si9A:
undetectable		 4ypeA-3si9A:
18.87
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.
5A6I_A_TCWA1124_1
(TRANSTHYRETIN)		 3si9 DIHYDRODIPICOLINATE
SYNTHASE
(Bartonella
henselae) 		4 / 6 LEU A 264
ALA A 260
LEU A 266
VAL A 248
 None
 0.76A 5a6iA-3si9A:
undetectable		 5a6iA-3si9A:
19.37
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.
5CR1_A_T44A201_1
(TRANSTHYRETIN)		 3si9 DIHYDRODIPICOLINATE
SYNTHASE
(Bartonella
henselae) 		4 / 5 LEU A 264
ALA A 260
LEU A 266
VAL A 248
 None
 0.91A 5cr1A-3si9A:
undetectable		 5cr1A-3si9A:
17.14
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.
5ESG_A_1YNA701_2
(LANOSTEROL 14-ALPHA
DEMETHYLASE)		 3si9 DIHYDRODIPICOLINATE
SYNTHASE
(Bartonella
henselae) 		4 / 4 LEU A  55
TYR A 137
PRO A  45
ILE A  64
 None
 1.34A 5esgA-3si9A:
undetectable		 5esgA-3si9A:
21.10
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.
5ITZ_B_LOCB502_1
(TUBULIN BETA-2B
CHAIN)		 3si9 DIHYDRODIPICOLINATE
SYNTHASE
(Bartonella
henselae) 		5 / 12 ALA A 293
LEU A 244
ALA A 260
LYS A 263
ILE A 257
 None
 0.99A 5itzB-3si9A:
undetectable		 5itzB-3si9A:
20.66
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.
5M50_B_TA1B502_1
(TUBULIN BETA-2B
CHAIN)		 3si9 DIHYDRODIPICOLINATE
SYNTHASE
(Bartonella
henselae) 		5 / 12 VAL A  10
SER A  44
THR A 169
GLN A 178
GLY A 164
 None
 1.47A 5m50B-3si9A:
3.0		 5m50B-3si9A:
21.58
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.
5MIO_B_LOCB502_1
(TUBULIN BETA CHAIN)		 3si9 DIHYDRODIPICOLINATE
SYNTHASE
(Bartonella
henselae) 		5 / 12 ALA A 293
LEU A 244
ALA A 260
LYS A 263
ILE A 257
 None
 0.98A 5mioB-3si9A:
undetectable		 5mioB-3si9A:
20.66
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.
5XIW_B_LOCB504_2
(TUBULIN BETA CHAIN)		 3si9 DIHYDRODIPICOLINATE
SYNTHASE
(Bartonella
henselae) 		5 / 12 ALA A 293
LEU A 244
ALA A 260
LYS A 263
ILE A 257
 None
 1.01A 5xiwB-3si9A:
undetectable		 5xiwB-3si9A:
12.42
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.
6GNG_A_QPSA601_1
(-)		 3si9 DIHYDRODIPICOLINATE
SYNTHASE
(Bartonella
henselae) 		5 / 12 GLY A 191
LEU A 189
THR A 108
ASN A 200
GLN A 178
 None
 1.08A 6gngA-3si9A:
undetectable		 6gngA-3si9A:
23.14
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.
6GNR_A_6J3A201_0
(TRANSTHYRETIN)		 3si9 DIHYDRODIPICOLINATE
SYNTHASE
(Bartonella
henselae) 		4 / 4 LYS A 263
LEU A 296
ALA A 260
LEU A 295
 None
 1.40A 6gnrA-3si9A:
undetectable		 6gnrA-3si9A:
20.25
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.
6GNR_B_6J3B201_0
(TRANSTHYRETIN)		 3si9 DIHYDRODIPICOLINATE
SYNTHASE
(Bartonella
henselae) 		4 / 4 LYS A 263
LEU A 296
ALA A 260
LEU A 295
 None
 1.40A 6gnrB-3si9A:
undetectable		 6gnrB-3si9A:
20.25