SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3ble'

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.
1HK3_A_T44A3002_1
(SERUM ALBUMIN)		 3ble CITRAMALATE SYNTHASE
FROM LEPTOSPIRA
INTERROGANS
(Leptospira
interrogans) 		4 / 8 GLN A 221
LEU A 249
LEU A   8
SER A 257
 None
 0.94A 1hk3A-3bleA:
undetectable		 1hk3A-3bleA:
19.25
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.
1KQB_B_BEZB525_0
(OXYGEN-INSENSITIVE
NAD(P)H
NITROREDUCTASE)		 3ble CITRAMALATE SYNTHASE
FROM LEPTOSPIRA
INTERROGANS
(Leptospira
interrogans) 		4 / 5 GLU A 292
GLY A 291
THR A 296
PHE A 295
 None
 1.32A 1kqbA-3bleA:
undetectable
1kqbB-3bleA:
undetectable		 1kqbA-3bleA:
22.78
1kqbB-3bleA:
22.78
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.
1SBR_A_VIBA501_1
(YKOF)		 3ble CITRAMALATE SYNTHASE
FROM LEPTOSPIRA
INTERROGANS
(Leptospira
interrogans) 		4 / 8 PHE A 175
ILE A 135
ILE A 141
LYS A 140
 None
 0.95A 1sbrA-3bleA:
undetectable		 1sbrA-3bleA:
22.19
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.
2X7H_A_PFNA1372_1
(ZINC-BINDING ALCOHOL
DEHYDROGENASE
DOMAIN-CONTAINING
PROTEIN 2)		 3ble CITRAMALATE SYNTHASE
FROM LEPTOSPIRA
INTERROGANS
(Leptospira
interrogans) 		5 / 11 TYR A 144
LEU A 103
LEU A 101
LEU A 104
HIS A 207
 MLI  A 701 ( 4.0A)
None
None
MLI  A 701 ( 4.9A)
ZN  A1003 ( 3.4A)
 1.45A 2x7hA-3bleA:
0.4
2x7hB-3bleA:
0.2		 2x7hA-3bleA:
23.90
2x7hB-3bleA:
23.90
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.
2X7H_B_PFNB1374_1
(ZINC-BINDING ALCOHOL
DEHYDROGENASE
DOMAIN-CONTAINING
PROTEIN 2)		 3ble CITRAMALATE SYNTHASE
FROM LEPTOSPIRA
INTERROGANS
(Leptospira
interrogans) 		4 / 4 TYR A 144
LEU A 103
LEU A 104
HIS A 207
 MLI  A 701 ( 4.0A)
None
MLI  A 701 ( 4.9A)
ZN  A1003 ( 3.4A)
 1.36A 2x7hB-3bleA:
undetectable		 2x7hB-3bleA:
23.90
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.
3GSS_A_EAAA212_1
(GLUTATHIONE
S-TRANSFERASE P1-1)		 3ble CITRAMALATE SYNTHASE
FROM LEPTOSPIRA
INTERROGANS
(Leptospira
interrogans) 		4 / 7 PHE A 206
VAL A 227
ILE A 253
GLY A 229
 None
 0.95A 3gssA-3bleA:
undetectable		 3gssA-3bleA:
21.39
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.
3GSS_B_EAAB211_1
(GLUTATHIONE
S-TRANSFERASE P1-1)		 3ble CITRAMALATE SYNTHASE
FROM LEPTOSPIRA
INTERROGANS
(Leptospira
interrogans) 		4 / 7 PHE A 206
VAL A 227
ILE A 253
GLY A 229
 None
 0.94A 3gssB-3bleA:
undetectable		 3gssB-3bleA:
21.39
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.
3HS6_B_EPAB1_2
(PROSTAGLANDIN G/H
SYNTHASE 2)		 3ble CITRAMALATE SYNTHASE
FROM LEPTOSPIRA
INTERROGANS
(Leptospira
interrogans) 		4 / 7 VAL A 159
VAL A 163
LEU A 166
SER A 167
 None
 0.38A 3hs6B-3bleA:
undetectable		 3hs6B-3bleA:
20.30
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.
3R9V_B_DXCB323_0
(INVASIN IPAD)		 3ble CITRAMALATE SYNTHASE
FROM LEPTOSPIRA
INTERROGANS
(Leptospira
interrogans) 		4 / 7 ILE A 171
ILE A 174
VAL A 163
LEU A 166
 None
 0.68A 3r9vA-3bleA:
undetectable
3r9vB-3bleA:
undetectable		 3r9vA-3bleA:
24.45
3r9vB-3bleA:
24.45
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.
3ZOD_A_HQEA1173_1
(FMN-BINDING PROTEIN)		 3ble CITRAMALATE SYNTHASE
FROM LEPTOSPIRA
INTERROGANS
(Leptospira
interrogans) 		4 / 7 ASP A 147
ARG A 240
HIS A 209
HIS A 111
 None
None
ZN  A1003 ( 3.4A)
None
 1.40A 3zodA-3bleA:
undetectable		 3zodA-3bleA:
21.75
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.
4KF9_A_ACTA407_0
(GLUTATHIONE
S-TRANSFERASE
PROTEIN)		 3ble CITRAMALATE SYNTHASE
FROM LEPTOSPIRA
INTERROGANS
(Leptospira
interrogans) 		3 / 3 GLU A   9
ARG A 173
HIS A 203
 None
 0.80A 4kf9A-3bleA:
undetectable		 4kf9A-3bleA:
22.01
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.
4L1A_A_AB1A101_2
(MDR769 HIV-1
PROTEASE)		 3ble CITRAMALATE SYNTHASE
FROM LEPTOSPIRA
INTERROGANS
(Leptospira
interrogans) 		4 / 6 ASN A 150
ASP A 178
GLY A 191
PRO A 156
 None
 1.11A 4l1aB-3bleA:
undetectable		 4l1aB-3bleA:
15.27
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.
4R3A_B_RBFB402_1
(BLUE-LIGHT-ACTIVATED
HISTIDINE KINASE 2)		 3ble CITRAMALATE SYNTHASE
FROM LEPTOSPIRA
INTERROGANS
(Leptospira
interrogans) 		5 / 10 ILE A 289
GLU A 247
ASN A 235
LEU A  42
PHE A 321
 None
 1.44A 4r3aB-3bleA:
undetectable		 4r3aB-3bleA:
23.43
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.
4XP9_C_1WEC706_1
(TRANSPORTER)		 3ble CITRAMALATE SYNTHASE
FROM LEPTOSPIRA
INTERROGANS
(Leptospira
interrogans) 		4 / 4 PHE A 152
ASP A 178
GLY A 191
SER A 149
 None
 1.41A 4xp9C-3bleA:
undetectable		 4xp9C-3bleA:
21.30
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.
4YGF_C_AZMC303_1
(ALPHA-CARBONIC
ANHYDRASE)		 3ble CITRAMALATE SYNTHASE
FROM LEPTOSPIRA
INTERROGANS
(Leptospira
interrogans) 		5 / 11 ASN A 243
HIS A 207
HIS A 231
VAL A  13
LEU A  81
 ZN  A1003 ( 4.5A)
ZN  A1003 ( 3.4A)
None
None
None
 1.27A 4ygfC-3bleA:
undetectable		 4ygfC-3bleA:
20.71
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.
4YGF_D_AZMD303_1
(ALPHA-CARBONIC
ANHYDRASE)		 3ble CITRAMALATE SYNTHASE
FROM LEPTOSPIRA
INTERROGANS
(Leptospira
interrogans) 		5 / 11 ASN A 243
HIS A 207
HIS A 231
VAL A  13
LEU A  81
 ZN  A1003 ( 4.5A)
ZN  A1003 ( 3.4A)
None
None
None
 1.18A 4ygfD-3bleA:
undetectable		 4ygfD-3bleA:
20.71
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.
4YGF_G_AZMG303_1
(ALPHA-CARBONIC
ANHYDRASE)		 3ble CITRAMALATE SYNTHASE
FROM LEPTOSPIRA
INTERROGANS
(Leptospira
interrogans) 		5 / 12 ASN A 243
HIS A 207
HIS A 231
VAL A  13
LEU A  81
 ZN  A1003 ( 4.5A)
ZN  A1003 ( 3.4A)
None
None
None
 1.23A 4ygfG-3bleA:
undetectable		 4ygfG-3bleA:
20.71
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.
5GWX_A_SAMA301_0
(GLYCINE SARCOSINE
N-METHYLTRANSFERASE)		 3ble CITRAMALATE SYNTHASE
FROM LEPTOSPIRA
INTERROGANS
(Leptospira
interrogans) 		5 / 12 GLY A 242
GLY A 208
SER A 215
GLY A  18
LEU A  11
 None
 1.04A 5gwxA-3bleA:
undetectable		 5gwxA-3bleA:
20.62
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.
5JSD_B_1GNB603_1
(PHIAB6 TAILSPIKE)		 3ble CITRAMALATE SYNTHASE
FROM LEPTOSPIRA
INTERROGANS
(Leptospira
interrogans) 		3 / 3 VAL A  13
GLU A   9
GLU A 205
 None
 0.93A 5jsdB-3bleA:
undetectable
5jsdC-3bleA:
undetectable		 5jsdB-3bleA:
20.25
5jsdC-3bleA:
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.
5JWA_H_ACTH612_0
(NADH DEHYDROGENASE,
PUTATIVE)		 3ble CITRAMALATE SYNTHASE
FROM LEPTOSPIRA
INTERROGANS
(Leptospira
interrogans) 		3 / 3 ARG A 287
PRO A 245
ASN A 210
 None
 1.06A 5jwaA-3bleA:
undetectable
5jwaH-3bleA:
undetectable		 5jwaA-3bleA:
22.46
5jwaH-3bleA:
22.46
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.
5OGJ_A_ACTA307_0
(CARBONIC ANHYDRASE
13)		 3ble CITRAMALATE SYNTHASE
FROM LEPTOSPIRA
INTERROGANS
(Leptospira
interrogans) 		4 / 6 HIS A 207
HIS A 231
VAL A  13
LEU A  81
 ZN  A1003 ( 3.4A)
None
None
None
 1.18A 5ogjA-3bleA:
undetectable		 5ogjA-3bleA:
21.45
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.
5OGJ_B_ACTB305_0
(CARBONIC ANHYDRASE
13)		 3ble CITRAMALATE SYNTHASE
FROM LEPTOSPIRA
INTERROGANS
(Leptospira
interrogans) 		4 / 6 HIS A 207
HIS A 231
VAL A  13
LEU A  81
 ZN  A1003 ( 3.4A)
None
None
None
 1.20A 5ogjB-3bleA:
undetectable		 5ogjB-3bleA:
21.45
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.
5OHH_A_ACTA307_0
(CARBONIC ANHYDRASE
13)		 3ble CITRAMALATE SYNTHASE
FROM LEPTOSPIRA
INTERROGANS
(Leptospira
interrogans) 		4 / 5 HIS A 207
HIS A 231
VAL A  13
LEU A  81
 ZN  A1003 ( 3.4A)
None
None
None
 1.20A 5ohhA-3bleA:
undetectable		 5ohhA-3bleA:
21.45
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.
5OHH_B_ACTB311_0
(CARBONIC ANHYDRASE
13)		 3ble CITRAMALATE SYNTHASE
FROM LEPTOSPIRA
INTERROGANS
(Leptospira
interrogans) 		4 / 6 HIS A 207
HIS A 231
VAL A  13
LEU A  81
 ZN  A1003 ( 3.4A)
None
None
None
 1.19A 5ohhB-3bleA:
undetectable		 5ohhB-3bleA:
21.45
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.
5SYJ_B_NIZB809_1
(CATALASE-PEROXIDASE)		 3ble CITRAMALATE SYNTHASE
FROM LEPTOSPIRA
INTERROGANS
(Leptospira
interrogans) 		4 / 8 GLY A  57
GLN A  63
LEU A  59
THR A  61
 None
 0.87A 5syjB-3bleA:
undetectable		 5syjB-3bleA:
18.29
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.
6B3B_A_SAMA701_0
(APRA
METHYLTRANSFERASE 1)		 3ble CITRAMALATE SYNTHASE
FROM LEPTOSPIRA
INTERROGANS
(Leptospira
interrogans) 		5 / 12 HIS A 203
GLY A 226
ALA A 225
ILE A 253
LEU A   8
 None
 1.12A 6b3bA-3bleA:
undetectable		 6b3bA-3bleA:
20.40