SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4e4g'

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.
1ETA_2_T442129_1
(TRANSTHYRETIN)		 4e4g METHYLMALONATE-SEMIA
LDEHYDE
DEHYDROGENASE
(Sinorhizobium
meliloti) 		4 / 5 LYS A  69
LEU A  73
ALA A 190
LEU A 186
 None
 1.17A 1eta2-4e4gA:
undetectable		 1eta2-4e4gA:
12.67
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.
1F86_B_T44B528_1
(TRANSTHYRETIN
THR119MET VARIANT)		 4e4g METHYLMALONATE-SEMIA
LDEHYDE
DEHYDROGENASE
(Sinorhizobium
meliloti) 		4 / 4 LYS A  69
LEU A  73
ALA A 190
LEU A 186
 None
 1.15A 1f86B-4e4gA:
undetectable		 1f86B-4e4gA:
13.44
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.
1JO4_A_DVAA6_0
(GRAMICIDIN C)		 4e4g METHYLMALONATE-SEMIA
LDEHYDE
DEHYDROGENASE
(Sinorhizobium
meliloti) 		3 / 3 ALA A 167
VAL A 138
TRP A 470
 None
 0.94A 1jo4A-4e4gA:
undetectable		 1jo4A-4e4gA:
4.13
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.
1JO4_B_DVAB6_0
(GRAMICIDIN C)		 4e4g METHYLMALONATE-SEMIA
LDEHYDE
DEHYDROGENASE
(Sinorhizobium
meliloti) 		3 / 3 ALA A 167
VAL A 138
TRP A 470
 None
 0.95A 1jo4B-4e4gA:
undetectable		 1jo4B-4e4gA:
4.13
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.
1P7L_C_SAMC685_1
(S-ADENOSYLMETHIONINE
SYNTHETASE)		 4e4g METHYLMALONATE-SEMIA
LDEHYDE
DEHYDROGENASE
(Sinorhizobium
meliloti) 		4 / 8 ALA A 235
ASP A 215
ILE A 216
ILE A 169
 None
 0.93A 1p7lD-4e4gA:
undetectable		 1p7lD-4e4gA:
20.84
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.
1P7L_C_SAMC885_0
(S-ADENOSYLMETHIONINE
SYNTHETASE)		 4e4g METHYLMALONATE-SEMIA
LDEHYDE
DEHYDROGENASE
(Sinorhizobium
meliloti) 		4 / 8 ALA A 235
ASP A 215
ILE A 216
ILE A 169
 None
 0.93A 1p7lC-4e4gA:
undetectable		 1p7lC-4e4gA:
20.84
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.
1ZLQ_A_ACTA1502_0
(NICKEL-BINDING
PERIPLASMIC PROTEIN)		 4e4g METHYLMALONATE-SEMIA
LDEHYDE
DEHYDROGENASE
(Sinorhizobium
meliloti) 		4 / 5 PRO A 442
GLY A 410
ASN A 409
GLY A 450
 None
 0.83A 1zlqA-4e4gA:
undetectable		 1zlqA-4e4gA:
22.81
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)		 4e4g METHYLMALONATE-SEMIA
LDEHYDE
DEHYDROGENASE
(Sinorhizobium
meliloti) 		4 / 5 GLN A 461
TRP A 156
VAL A 106
SER A 466
 None
 1.49A 1zzuA-4e4gA:
undetectable		 1zzuA-4e4gA:
22.63
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.
2AOJ_C_FRDC305_1
(POL POLYPROTEIN
PEPTIDE INHIBITOR)		 4e4g METHYLMALONATE-SEMIA
LDEHYDE
DEHYDROGENASE
(Sinorhizobium
meliloti) 		4 / 5 LEU A  85
ASP A  99
PRO A 180
VAL A 179
 None
 0.87A 2aojA-4e4gA:
undetectable		 2aojA-4e4gA:
12.77
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_A_SAMA301_0
(CEPHALOSPORIN
HYDROXYLASE CMCI)		 4e4g METHYLMALONATE-SEMIA
LDEHYDE
DEHYDROGENASE
(Sinorhizobium
meliloti) 		6 / 12 GLU A 174
GLY A 202
SER A  19
ASP A 203
ALA A 206
ALA A 209
 None
 1.22A 2br4A-4e4gA:
3.7		 2br4A-4e4gA:
17.21
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_0
(CEPHALOSPORIN
HYDROXYLASE CMCI)		 4e4g METHYLMALONATE-SEMIA
LDEHYDE
DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 12 GLU A 174
GLY A 202
ASP A 203
ALA A 206
ALA A 209
 None
 1.03A 2br4E-4e4gA:
3.7		 2br4E-4e4gA:
17.21
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_F_SAMF301_0
(CEPHALOSPORIN
HYDROXYLASE CMCI)		 4e4g METHYLMALONATE-SEMIA
LDEHYDE
DEHYDROGENASE
(Sinorhizobium
meliloti) 		6 / 12 GLU A 174
GLY A 202
SER A  19
ASP A 203
ALA A 206
ALA A 209
 None
 1.09A 2br4F-4e4gA:
3.7		 2br4F-4e4gA:
17.21
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)		 4e4g METHYLMALONATE-SEMIA
LDEHYDE
DEHYDROGENASE
(Sinorhizobium
meliloti) 		4 / 7 PHE A 424
ARG A 427
ASP A 423
TYR A 395
 None
 1.24A 2e5dA-4e4gA:
undetectable
2e5dB-4e4gA:
undetectable		 2e5dA-4e4gA:
23.16
2e5dB-4e4gA:
23.16
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)		 4e4g METHYLMALONATE-SEMIA
LDEHYDE
DEHYDROGENASE
(Sinorhizobium
meliloti) 		4 / 7 ASP A 423
TYR A 395
PHE A 424
ARG A 427
 None
 1.24A 2e5dA-4e4gA:
undetectable
2e5dB-4e4gA:
undetectable		 2e5dA-4e4gA:
23.16
2e5dB-4e4gA:
23.16
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.
2G70_B_SAMB2002_0
(PHENYLETHANOLAMINE
N-METHYLTRANSFERASE)		 4e4g METHYLMALONATE-SEMIA
LDEHYDE
DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 12 LEU A 296
HIS A 251
ALA A 343
PHE A 368
VAL A 284
 None
 1.28A 2g70B-4e4gA:
undetectable		 2g70B-4e4gA:
20.79
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.
2HRE_B_CHDB701_0
(FERROCHELATASE)		 4e4g METHYLMALONATE-SEMIA
LDEHYDE
DEHYDROGENASE
(Sinorhizobium
meliloti) 		3 / 3 LYS A  91
GLY A 151
PRO A 154
 None
 0.98A 2hreB-4e4gA:
undetectable		 2hreB-4e4gA:
19.02
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.
2RCT_A_RTLA140_0
(RETINOL-BINDING
PROTEIN II, CELLULAR)		 4e4g METHYLMALONATE-SEMIA
LDEHYDE
DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 12 MET A 252
ILE A 282
ALA A 266
VAL A 346
LEU A 387
 None
 1.19A 2rctA-4e4gA:
undetectable		 2rctA-4e4gA:
12.86
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.
2VOU_A_ACTA1397_0
(2,6-DIHYDROXYPYRIDIN
E HYDROXYLASE)		 4e4g METHYLMALONATE-SEMIA
LDEHYDE
DEHYDROGENASE
(Sinorhizobium
meliloti) 		3 / 3 PRO A 385
GLY A 365
TYR A 272
 None
 0.72A 2vouA-4e4gA:
2.2		 2vouA-4e4gA:
20.22
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.
2XCT_G_CPFG1020_1
(DNA GYRASE SUBUNIT
B, DNA GYRASE
SUBUNIT A)		 4e4g METHYLMALONATE-SEMIA
LDEHYDE
DEHYDROGENASE
(Sinorhizobium
meliloti) 		3 / 3 ARG A 102
GLY A 103
SER A 466
 None
 0.64A 2xctB-4e4gA:
undetectable		 2xctB-4e4gA:
22.25
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.
3BJW_B_SVRB501_2
(PHOSPHOLIPASE A2)		 4e4g METHYLMALONATE-SEMIA
LDEHYDE
DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 11 VAL A 304
LEU A 307
GLY A 365
ILE A 363
PRO A 385
 None
 1.15A 3bjwB-4e4gA:
undetectable		 3bjwB-4e4gA:
11.74
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.
3GV1_B_BEZB303_0
(DISULFIDE
INTERCHANGE PROTEIN)		 4e4g METHYLMALONATE-SEMIA
LDEHYDE
DEHYDROGENASE
(Sinorhizobium
meliloti) 		4 / 4 LEU A 401
ALA A 392
VAL A 288
PRO A 287
 None
 1.18A 3gv1B-4e4gA:
undetectable		 3gv1B-4e4gA:
14.86
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.
3IJX_B_HCZB800_1
(GLUTAMATE RECEPTOR 2)		 4e4g METHYLMALONATE-SEMIA
LDEHYDE
DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 10 PRO A 385
LEU A 307
ILE A 309
SER A 274
GLY A 320
 None
 1.34A 3ijxB-4e4gA:
undetectable
3ijxD-4e4gA:
undetectable		 3ijxB-4e4gA:
20.12
3ijxD-4e4gA:
20.12
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.
3T8N_D_EDTD135_0
(STEROID
DELTA-ISOMERASE)		 4e4g METHYLMALONATE-SEMIA
LDEHYDE
DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 11 GLY A 151
PRO A 150
PRO A 154
PRO A 172
ASP A 176
 None
 1.37A 3t8nD-4e4gA:
undetectable
3t8nF-4e4gA:
undetectable		 3t8nD-4e4gA:
14.79
3t8nF-4e4gA:
14.79
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.
3V4T_C_ACTC502_0
(UDP-N-ACETYLGLUCOSAM
INE
1-CARBOXYVINYLTRANSF
ERASE)		 4e4g METHYLMALONATE-SEMIA
LDEHYDE
DEHYDROGENASE
(Sinorhizobium
meliloti) 		3 / 3 PRO A 177
ASP A 176
GLU A 174
 None
 0.71A 3v4tC-4e4gA:
0.9		 3v4tC-4e4gA:
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.
4FGL_B_CLQB303_0
(RIBOSYLDIHYDRONICOTI
NAMIDE DEHYDROGENASE
[QUINONE])		 4e4g METHYLMALONATE-SEMIA
LDEHYDE
DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 11 PHE A 149
ILE A 153
GLY A 223
GLY A 246
ASN A 409
 None
 1.46A 4fglA-4e4gA:
2.8
4fglB-4e4gA:
undetectable		 4fglA-4e4gA:
17.70
4fglB-4e4gA:
17.70
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.
4KSZ_A_CYSA620_0
(LACTOPEROXIDASE)		 4e4g METHYLMALONATE-SEMIA
LDEHYDE
DEHYDROGENASE
(Sinorhizobium
meliloti) 		3 / 3 ARG A 278
GLU A 277
PHE A 147
 None
 1.02A 4kszA-4e4gA:
undetectable		 4kszA-4e4gA:
22.88
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)		 4e4g METHYLMALONATE-SEMIA
LDEHYDE
DEHYDROGENASE
(Sinorhizobium
meliloti) 		4 / 5 GLY A 273
SER A 274
ALA A 275
GLU A 277
 None
 1.01A 4m93B-4e4gA:
undetectable
4m93C-4e4gA:
undetectable		 4m93B-4e4gA:
16.54
4m93C-4e4gA:
16.79
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.
4MME_B_29QB603_1
(TRANSPORTER)		 4e4g METHYLMALONATE-SEMIA
LDEHYDE
DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 9 ASP A 465
ALA A 242
GLY A 449
PHE A 245
GLY A 457
 None
 1.30A 4mmeB-4e4gA:
undetectable		 4mmeB-4e4gA:
23.54
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.
4OAD_A_CLMA205_0
(GNAT SUPERFAMILY
ACETYLTRANSFERASE
PA4794)		 4e4g METHYLMALONATE-SEMIA
LDEHYDE
DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 12 PHE A 147
GLU A 174
ARG A 175
GLY A  31
TYR A   0
 None
 1.35A 4oadA-4e4gA:
undetectable		 4oadA-4e4gA:
13.80
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.
4QYN_A_RTLA201_0
(RETINOL-BINDING
PROTEIN 2)		 4e4g METHYLMALONATE-SEMIA
LDEHYDE
DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 12 MET A 252
ILE A 282
ALA A 266
VAL A 346
LEU A 387
 None
 1.19A 4qynA-4e4gA:
undetectable		 4qynA-4e4gA:
12.80
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.
4R20_A_AERA602_1
(CYTOCHROME P450
FAMILY 17
POLYPEPTIDE 2)		 4e4g METHYLMALONATE-SEMIA
LDEHYDE
DEHYDROGENASE
(Sinorhizobium
meliloti) 		4 / 8 ASN A 429
GLU A 406
VAL A 284
SER A 283
 None
 0.79A 4r20A-4e4gA:
undetectable		 4r20A-4e4gA:
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.
4WNU_C_QDNC602_1
(CYTOCHROME P450 2D6)		 4e4g METHYLMALONATE-SEMIA
LDEHYDE
DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 11 PHE A 149
GLY A 320
GLU A 277
ALA A  96
ASP A  99
 None
 0.79A 4wnuC-4e4gA:
undetectable		 4wnuC-4e4gA:
21.91
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.
4WNU_D_QDND602_1
(CYTOCHROME P450 2D6)		 4e4g METHYLMALONATE-SEMIA
LDEHYDE
DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 10 PHE A 149
GLY A 320
GLU A 277
ALA A  96
ASP A  99
 None
 0.91A 4wnuD-4e4gA:
undetectable		 4wnuD-4e4gA:
21.91
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.
4Z4C_A_IPHA903_0
(PROTEIN ARGONAUTE-2)		 4e4g METHYLMALONATE-SEMIA
LDEHYDE
DEHYDROGENASE
(Sinorhizobium
meliloti) 		4 / 6 ARG A 332
GLN A 329
ILE A 335
ASP A 336
 None
 1.17A 4z4cA-4e4gA:
3.2		 4z4cA-4e4gA:
20.20
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.
5D0Y_A_FOLA201_0
(CONSERVED
HYPOTHETICAL
MEMBRANE PROTEIN)		 4e4g METHYLMALONATE-SEMIA
LDEHYDE
DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 12 LEU A 186
GLY A 191
ASP A   7
SER A  47
ASN A 198
 None
 1.26A 5d0yA-4e4gA:
undetectable		 5d0yA-4e4gA:
17.41
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.
5HS1_A_VORA602_1
(LANOSTEROL 14-ALPHA
DEMETHYLASE)		 4e4g METHYLMALONATE-SEMIA
LDEHYDE
DEHYDROGENASE
(Sinorhizobium
meliloti) 		4 / 8 ILE A 100
THR A 145
LEU A 170
LEU A 197
 None
 0.85A 5hs1A-4e4gA:
undetectable		 5hs1A-4e4gA:
21.64
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.
5JLC_A_1YNA602_2
(LANOSTEROL 14-ALPHA
DEMETHYLASE)		 4e4g METHYLMALONATE-SEMIA
LDEHYDE
DEHYDROGENASE
(Sinorhizobium
meliloti) 		4 / 5 GLY A  31
THR A  32
GLY A 273
LEU A  85
 None
 0.85A 5jlcA-4e4gA:
undetectable		 5jlcA-4e4gA:
22.51
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.
5LBT_A_6T0A304_1
(RIBOSYLDIHYDRONICOTI
NAMIDE DEHYDROGENASE
[QUINONE])		 4e4g METHYLMALONATE-SEMIA
LDEHYDE
DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 10 GLY A 223
GLY A 246
ASN A 409
PHE A 149
ILE A 153
 None
 1.37A 5lbtA-4e4gA:
undetectable
5lbtB-4e4gA:
undetectable		 5lbtA-4e4gA:
17.52
5lbtB-4e4gA:
17.52