SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3r64'

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.
1GMK_D_DVAD6_0
(GRAMICIDIN A)		 3r64 NAD DEPENDENT
BENZALDEHYDE
DEHYDROGENASE
(Corynebacterium
glutamicum) 		4 / 4 VAL A 300
TRP A 421
ALA A 419
VAL A 269
 VAL  A 300 ( 0.6A)
TRP  A 421 ( 0.5A)
ALA  A 419 ( 0.0A)
VAL  A 269 ( 0.6A)
 1.13A 1gmkC-3r64A:
undetectable
1gmkD-3r64A:
undetectable		 1gmkC-3r64A:
3.70
1gmkD-3r64A:
3.70
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.
1R5L_A_VIVA301_0
(PROTEIN
(ALPHA-TOCOPHEROL
TRANSFER PROTEIN))		 3r64 NAD DEPENDENT
BENZALDEHYDE
DEHYDROGENASE
(Corynebacterium
glutamicum) 		5 / 12 PHE A   7
ILE A 181
ILE A  92
ILE A 166
ILE A 111
 PHE  A   7 ( 1.3A)
ILE  A 181 ( 0.7A)
ILE  A  92 ( 0.7A)
ILE  A 166 ( 0.7A)
ILE  A 111 ( 0.7A)
 1.21A 1r5lA-3r64A:
undetectable		 1r5lA-3r64A:
19.09
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.
1SDT_B_MK1B902_2
(PROTEASE RETROPEPSIN)		 3r64 NAD DEPENDENT
BENZALDEHYDE
DEHYDROGENASE
(Corynebacterium
glutamicum) 		5 / 12 GLY A 285
ALA A 286
ILE A 389
VAL A 396
ILE A 394
 GLY  A 285 ( 0.0A)
ALA  A 286 ( 0.0A)
ILE  A 389 ( 0.7A)
VAL  A 396 ( 0.6A)
ILE  A 394 ( 0.7A)
 0.84A 1sdtB-3r64A:
undetectable		 1sdtB-3r64A:
11.59
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.
2AVO_B_MK1B902_2
(POL POLYPROTEIN)		 3r64 NAD DEPENDENT
BENZALDEHYDE
DEHYDROGENASE
(Corynebacterium
glutamicum) 		5 / 12 GLY A 285
ALA A 286
ILE A 389
VAL A 396
ILE A 394
 GLY  A 285 ( 0.0A)
ALA  A 286 ( 0.0A)
ILE  A 389 ( 0.7A)
VAL  A 396 ( 0.6A)
ILE  A 394 ( 0.7A)
 0.83A 2avoB-3r64A:
undetectable		 2avoB-3r64A:
11.59
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.
2HJH_B_NCAB901_0
(NAD-DEPENDENT
HISTONE DEACETYLASE
SIR2)		 3r64 NAD DEPENDENT
BENZALDEHYDE
DEHYDROGENASE
(Corynebacterium
glutamicum) 		4 / 5 ILE A 181
PRO A 183
PHE A 223
VAL A 212
 ILE  A 181 ( 0.7A)
PRO  A 183 ( 1.1A)
PHE  A 223 ( 1.3A)
VAL  A 212 ( 0.6A)
 1.39A 2hjhB-3r64A:
undetectable		 2hjhB-3r64A:
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.
2R5P_B_MK1B902_2
(PROTEASE)		 3r64 NAD DEPENDENT
BENZALDEHYDE
DEHYDROGENASE
(Corynebacterium
glutamicum) 		5 / 12 GLY A 285
ALA A 286
ILE A 389
VAL A 396
ILE A 394
 GLY  A 285 ( 0.0A)
ALA  A 286 ( 0.0A)
ILE  A 389 ( 0.7A)
VAL  A 396 ( 0.6A)
ILE  A 394 ( 0.7A)
 0.87A 2r5pB-3r64A:
undetectable		 2r5pB-3r64A:
11.99
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.
2R5P_D_MK1D902_2
(PROTEASE)		 3r64 NAD DEPENDENT
BENZALDEHYDE
DEHYDROGENASE
(Corynebacterium
glutamicum) 		5 / 12 GLY A 285
ALA A 286
ILE A 389
VAL A 396
ILE A 394
 GLY  A 285 ( 0.0A)
ALA  A 286 ( 0.0A)
ILE  A 389 ( 0.7A)
VAL  A 396 ( 0.6A)
ILE  A 394 ( 0.7A)
 0.87A 2r5pD-3r64A:
undetectable		 2r5pD-3r64A:
11.99
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.
2XCT_H_CPFH1020_1
(DNA GYRASE SUBUNIT
B, DNA GYRASE
SUBUNIT A)		 3r64 NAD DEPENDENT
BENZALDEHYDE
DEHYDROGENASE
(Corynebacterium
glutamicum) 		3 / 3 ARG A 197
GLU A 200
SER A  44
 ARG  A 197 ( 0.6A)
GLU  A 200 ( 0.6A)
SER  A  44 ( 0.0A)
 0.73A 2xctD-3r64A:
undetectable		 2xctD-3r64A:
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.
3BWC_B_SAMB501_0
(SPERMIDINE SYNTHASE)		 3r64 NAD DEPENDENT
BENZALDEHYDE
DEHYDROGENASE
(Corynebacterium
glutamicum) 		5 / 12 ILE A 219
GLY A 220
VAL A 240
GLY A 214
ASP A 221
 ILE  A 219 ( 0.4A)
GLY  A 220 ( 0.0A)
VAL  A 240 ( 0.6A)
GLY  A 214 ( 0.0A)
ASP  A 221 ( 0.6A)
 1.03A 3bwcB-3r64A:
2.5		 3bwcB-3r64A:
21.18
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.
3EM4_A_DR7A100_1
(PROTEASE)		 3r64 NAD DEPENDENT
BENZALDEHYDE
DEHYDROGENASE
(Corynebacterium
glutamicum) 		5 / 11 GLY A 285
ALA A 286
ILE A 389
VAL A 396
ILE A 394
 GLY  A 285 ( 0.0A)
ALA  A 286 ( 0.0A)
ILE  A 389 ( 0.7A)
VAL  A 396 ( 0.6A)
ILE  A 394 ( 0.7A)
 0.90A 3em4A-3r64A:
undetectable		 3em4A-3r64A:
11.18
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.
3EM4_V_DR7V100_1
(PROTEASE)		 3r64 NAD DEPENDENT
BENZALDEHYDE
DEHYDROGENASE
(Corynebacterium
glutamicum) 		5 / 11 GLY A 285
ALA A 286
ILE A 389
VAL A 396
ILE A 394
 GLY  A 285 ( 0.0A)
ALA  A 286 ( 0.0A)
ILE  A 389 ( 0.7A)
VAL  A 396 ( 0.6A)
ILE  A 394 ( 0.7A)
 0.85A 3em4U-3r64A:
undetectable		 3em4U-3r64A:
11.18
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.
3NDX_A_RITA100_2
(PROTEASE)		 3r64 NAD DEPENDENT
BENZALDEHYDE
DEHYDROGENASE
(Corynebacterium
glutamicum) 		5 / 11 GLY A 285
ALA A 286
ILE A 389
VAL A 396
ILE A 394
 GLY  A 285 ( 0.0A)
ALA  A 286 ( 0.0A)
ILE  A 389 ( 0.7A)
VAL  A 396 ( 0.6A)
ILE  A 394 ( 0.7A)
 0.88A 3ndxB-3r64A:
undetectable		 3ndxB-3r64A:
11.59
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.
4M93_B_ACTB303_0
(S25-26 FAB (IGG1K)
HEAVY CHAIN
S25-26 FAB (IGG1K)
LIGHT CHAIN)		 3r64 NAD DEPENDENT
BENZALDEHYDE
DEHYDROGENASE
(Corynebacterium
glutamicum) 		4 / 5 SER A 233
ALA A 258
PHE A 234
GLU A 260
 SER  A 233 ( 0.0A)
ALA  A 258 ( 0.0A)
PHE  A 234 ( 1.3A)
GLU  A 260 ( 0.6A)
 1.04A 4m93B-3r64A:
undetectable
4m93C-3r64A:
undetectable		 4m93B-3r64A:
16.27
4m93C-3r64A:
19.28
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)		 3r64 NAD DEPENDENT
BENZALDEHYDE
DEHYDROGENASE
(Corynebacterium
glutamicum) 		3 / 3 VAL A 151
TYR A  56
ALA A  59
 VAL  A 151 ( 0.6A)
TYR  A  56 ( 1.3A)
ALA  A  59 ( 0.0A)
 0.29A 4ybnA-3r64A:
undetectable		 4ybnA-3r64A:
20.82
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.
5C0O_E_SAME301_0
(TRNA
(ADENINE(58)-N(1))-M
ETHYLTRANSFERASE
TRMI)		 3r64 NAD DEPENDENT
BENZALDEHYDE
DEHYDROGENASE
(Corynebacterium
glutamicum) 		5 / 12 ALA A  62
PRO A 205
GLY A  18
GLY A 207
ALA A  54
 ALA  A  62 ( 0.0A)
PRO  A 205 ( 1.1A)
GLY  A  18 ( 0.0A)
GLY  A 207 ( 0.0A)
ALA  A  54 ( 0.0A)
 1.14A 5c0oE-3r64A:
4.3		 5c0oE-3r64A:
20.53
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.
5D0X_K_BO2K301_1
(PROTEASOME SUBUNIT
BETA TYPE-5
PROTEASOME SUBUNIT
BETA TYPE-6)		 3r64 NAD DEPENDENT
BENZALDEHYDE
DEHYDROGENASE
(Corynebacterium
glutamicum) 		5 / 9 SER A 412
ALA A 409
ALA A 406
GLY A 415
ALA A 418
 SER  A 412 ( 0.0A)
ALA  A 409 ( 0.0A)
ALA  A 406 ( 0.0A)
GLY  A 415 ( 0.0A)
ALA  A 418 ( 0.0A)
 0.97A 5d0xK-3r64A:
undetectable
5d0xL-3r64A:
undetectable		 5d0xK-3r64A:
17.26
5d0xL-3r64A:
18.73
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.
5D0X_Y_BO2Y301_1
(PROTEASOME SUBUNIT
BETA TYPE-5
PROTEASOME SUBUNIT
BETA TYPE-6)		 3r64 NAD DEPENDENT
BENZALDEHYDE
DEHYDROGENASE
(Corynebacterium
glutamicum) 		5 / 9 SER A 412
ALA A 409
ALA A 406
GLY A 415
ALA A 418
 SER  A 412 ( 0.0A)
ALA  A 409 ( 0.0A)
ALA  A 406 ( 0.0A)
GLY  A 415 ( 0.0A)
ALA  A 418 ( 0.0A)
 0.96A 5d0xY-3r64A:
undetectable
5d0xZ-3r64A:
undetectable		 5d0xY-3r64A:
17.26
5d0xZ-3r64A:
18.73
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.
5NVP_A_ACAA18_1
(ENVELOPE
GLYCOPROTEIN,GP41)		 3r64 NAD DEPENDENT
BENZALDEHYDE
DEHYDROGENASE
(Corynebacterium
glutamicum) 		5 / 12 SER A 327
ASN A  34
GLU A  99
GLU A  94
LEU A  96
 SER  A 327 ( 0.0A)
ASN  A  34 ( 0.6A)
GLU  A  99 ( 0.6A)
GLU  A  94 ( 0.6A)
LEU  A  96 ( 0.6A)
 1.11A 5nvpA-3r64A:
0.0		 5nvpA-3r64A:
5.61
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.
5NY7_A_NCAA303_0
(AMIDASE)		 3r64 NAD DEPENDENT
BENZALDEHYDE
DEHYDROGENASE
(Corynebacterium
glutamicum) 		4 / 6 GLY A 334
PRO A 335
THR A 103
SER A 327
 GLY  A 334 ( 0.0A)
PRO  A 335 ( 1.1A)
THR  A 103 ( 0.8A)
SER  A 327 ( 0.0A)
 1.13A 5ny7A-3r64A:
undetectable		 5ny7A-3r64A:
22.44
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.
6FHW_A_ACRA801_2
(GLUCOAMYLASE P)		 3r64 NAD DEPENDENT
BENZALDEHYDE
DEHYDROGENASE
(Corynebacterium
glutamicum) 		3 / 3 TRP A  66
GLU A  65
GLU A  73
 TRP  A  66 ( 0.5A)
GLU  A  65 ( 0.6A)
GLU  A  73 ( 0.6A)
 0.68A 6fhwA-3r64A:
undetectable		 6fhwA-3r64A:
9.38