SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4it1'

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.
1DY4_A_SNPA437_1
(EXOGLUCANASE 1)		 4it1 PUTATIVE GLUCARATE
DEHYDRATASE
(Pseudomonas
fluorescens) 		5 / 12 ALA A 267
TYR A 244
SER A 145
GLU A 246
ASP A 293
 None
None
None
MG  A 501 (-2.8A)
None
 1.15A 1dy4A-4it1A:
undetectable		 1dy4A-4it1A:
21.73
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.
1NBH_C_SAMC2293_0
(GLYCINE
N-METHYLTRANSFERASE)		 4it1 PUTATIVE GLUCARATE
DEHYDRATASE
(Pseudomonas
fluorescens) 		5 / 12 ILE A 367
VAL A 372
SER A 318
SER A 321
HIS A 320
 None
 1.35A 1nbhC-4it1A:
undetectable		 1nbhC-4it1A:
20.63
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.
1PCG_A_ESTA1_1
(ESTROGEN RECEPTOR)		 4it1 PUTATIVE GLUCARATE
DEHYDRATASE
(Pseudomonas
fluorescens) 		5 / 10 LEU A 382
GLU A  47
LEU A 329
ILE A 374
LEU A 130
 None
 1.27A 1pcgA-4it1A:
undetectable		 1pcgA-4it1A:
21.52
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_1
(CEPHALOSPORIN
HYDROXYLASE CMCI)		 4it1 PUTATIVE GLUCARATE
DEHYDRATASE
(Pseudomonas
fluorescens) 		3 / 3 LYS A 191
ASP A 343
CYH A 310
 None
 1.47A 2br4F-4it1A:
undetectable		 2br4F-4it1A:
19.12
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.
2HA6_A_SCKA902_1
(ACETYLCHOLINESTERASE)		 4it1 PUTATIVE GLUCARATE
DEHYDRATASE
(Pseudomonas
fluorescens) 		5 / 10 GLU A  47
GLU A 358
LEU A 365
LEU A 329
TYR A 350
 None
 1.23A 2ha6A-4it1A:
undetectable		 2ha6A-4it1A:
23.06
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.
2HA6_B_SCKB952_1
(ACETYLCHOLINESTERASE)		 4it1 PUTATIVE GLUCARATE
DEHYDRATASE
(Pseudomonas
fluorescens) 		5 / 10 GLU A  47
GLU A 358
LEU A 365
LEU A 329
TYR A 350
 None
 1.18A 2ha6B-4it1A:
undetectable		 2ha6B-4it1A:
23.06
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.
2QHF_A_ACTA504_0
(CHORISMATE SYNTHASE)		 4it1 PUTATIVE GLUCARATE
DEHYDRATASE
(Pseudomonas
fluorescens) 		4 / 5 SER A 323
HIS A 349
ARG A 404
LEU A  18
 TLA  A 502 ( 4.9A)
TLA  A 502 (-4.7A)
TLA  A 502 (-2.9A)
None
 1.41A 2qhfA-4it1A:
undetectable		 2qhfA-4it1A:
23.74
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.
2XAD_E_GCSE710_1
(N-ACYL GLM
PEUDO-TEICOPLANIN
DEACETYLASE
TEICOPLANIN)		 4it1 PUTATIVE GLUCARATE
DEHYDRATASE
(Pseudomonas
fluorescens) 		4 / 8 HIS A 294
SER A 328
ILE A 327
HIS A 295
 None
 1.01A 2xadA-4it1A:
undetectable		 2xadA-4it1A:
21.13
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.
2XAD_F_GCSF710_1
(N-ACYL GLM
PEUDO-TEICOPLANIN
DEACETYLASE
TEICOPLANIN)		 4it1 PUTATIVE GLUCARATE
DEHYDRATASE
(Pseudomonas
fluorescens) 		4 / 8 HIS A 294
SER A 328
ILE A 327
HIS A 295
 None
 1.02A 2xadB-4it1A:
undetectable		 2xadB-4it1A:
21.13
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.
2XAD_G_GCSG710_1
(N-ACYL GLM
PEUDO-TEICOPLANIN
DEACETYLASE
TEICOPLANIN)		 4it1 PUTATIVE GLUCARATE
DEHYDRATASE
(Pseudomonas
fluorescens) 		4 / 8 HIS A 294
SER A 328
ILE A 327
HIS A 295
 None
 1.01A 2xadC-4it1A:
undetectable		 2xadC-4it1A:
21.13
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.
2XAD_H_GCSH710_1
(N-ACYL GLM
PEUDO-TEICOPLANIN
DEACETYLASE
TEICOPLANIN)		 4it1 PUTATIVE GLUCARATE
DEHYDRATASE
(Pseudomonas
fluorescens) 		4 / 8 HIS A 294
SER A 328
ILE A 327
HIS A 295
 None
 1.03A 2xadD-4it1A:
undetectable		 2xadD-4it1A:
21.13
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.
3BOY_A_HISA1001_0
(HUT OPERON POSITIVE
REGULATORY PROTEIN)		 4it1 PUTATIVE GLUCARATE
DEHYDRATASE
(Pseudomonas
fluorescens) 		5 / 10 ILE A 327
GLY A  46
ALA A 117
HIS A 294
HIS A 295
 None
 1.49A 3boyA-4it1A:
undetectable
3boyC-4it1A:
undetectable		 3boyA-4it1A:
14.54
3boyC-4it1A:
14.54
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.
3BOY_A_HISA2001_0
(HUT OPERON POSITIVE
REGULATORY PROTEIN)		 4it1 PUTATIVE GLUCARATE
DEHYDRATASE
(Pseudomonas
fluorescens) 		5 / 10 HIS A 294
HIS A 295
ILE A 327
GLY A  46
ALA A 117
 None
 1.50A 3boyA-4it1A:
undetectable
3boyB-4it1A:
undetectable		 3boyA-4it1A:
14.54
3boyB-4it1A:
14.54
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.
3BOY_A_HISA3001_0
(HUT OPERON POSITIVE
REGULATORY PROTEIN)		 4it1 PUTATIVE GLUCARATE
DEHYDRATASE
(Pseudomonas
fluorescens) 		5 / 10 HIS A 294
HIS A 295
ILE A 327
GLY A  46
ALA A 117
 None
 1.50A 3boyB-4it1A:
undetectable
3boyC-4it1A:
undetectable		 3boyB-4it1A:
14.54
3boyC-4it1A:
14.54
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.
3FBX_A_ACTA608_0
(PUTATIVE
PHOSPHOLIPASE B-LIKE
2)		 4it1 PUTATIVE GLUCARATE
DEHYDRATASE
(Pseudomonas
fluorescens) 		3 / 3 GLU A 141
VAL A 368
CYH A 371
 None
 1.06A 3fbxA-4it1A:
undetectable		 3fbxA-4it1A:
20.86
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.
3OKX_A_SAMA201_0
(YAEB-LIKE PROTEIN
RPA0152)		 4it1 PUTATIVE GLUCARATE
DEHYDRATASE
(Pseudomonas
fluorescens) 		5 / 12 LEU A  73
HIS A 294
GLY A  46
SER A  48
LEU A  76
 None
 1.26A 3okxA-4it1A:
undetectable		 3okxA-4it1A:
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.
3OKX_B_SAMB201_1
(YAEB-LIKE PROTEIN
RPA0152)		 4it1 PUTATIVE GLUCARATE
DEHYDRATASE
(Pseudomonas
fluorescens) 		5 / 12 LEU A  73
HIS A 294
GLY A  46
SER A  48
LEU A  76
 None
 1.25A 3okxB-4it1A:
undetectable		 3okxB-4it1A:
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.
3OZW_B_KKKB413_1
(FLAVOHEMOGLOBIN)		 4it1 PUTATIVE GLUCARATE
DEHYDRATASE
(Pseudomonas
fluorescens) 		5 / 12 ILE A 174
GLN A 177
HIS A  25
ILE A 367
PRO A 351
 None
None
TLA  A 502 (-4.1A)
None
None
 1.08A 3ozwB-4it1A:
undetectable		 3ozwB-4it1A:
25.20
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.
3SG9_B_KANB305_1
(APH(2'')-ID)		 4it1 PUTATIVE GLUCARATE
DEHYDRATASE
(Pseudomonas
fluorescens) 		4 / 8 ASN A 269
HIS A 349
ASP A 347
GLU A 202
 MG  A 501 (-2.5A)
TLA  A 502 (-4.7A)
None
None
 1.10A 3sg9B-4it1A:
undetectable		 3sg9B-4it1A:
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.
3SUD_C_SUEC1201_2
(NS3 PROTEASE, NS4A
PROTEIN)		 4it1 PUTATIVE GLUCARATE
DEHYDRATASE
(Pseudomonas
fluorescens) 		4 / 4 PHE A 187
TYR A 350
LEU A 192
LYS A 191
 None
 1.21A 3sudC-4it1A:
0.0		 3sudC-4it1A:
19.13
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.
3SUD_D_SUED1201_1
(NS3 PROTEASE, NS4A
PROTEIN)		 4it1 PUTATIVE GLUCARATE
DEHYDRATASE
(Pseudomonas
fluorescens) 		5 / 12 GLY A 195
ASP A 221
GLY A  23
ALA A  98
SER A 101
 None
MG  A 501 (-2.6A)
None
TLA  A 502 ( 4.8A)
None
 0.89A 3sudD-4it1A:
undetectable		 3sudD-4it1A:
19.13
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.
3SUD_D_SUED1201_2
(NS3 PROTEASE, NS4A
PROTEIN)		 4it1 PUTATIVE GLUCARATE
DEHYDRATASE
(Pseudomonas
fluorescens) 		4 / 5 PHE A 187
TYR A 350
LEU A 192
LYS A 191
 None
 1.43A 3sudD-4it1A:
undetectable		 3sudD-4it1A:
19.13
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.
3SUE_C_SUEC1201_2
(NS3 PROTEASE, NS4A
PROTEIN)		 4it1 PUTATIVE GLUCARATE
DEHYDRATASE
(Pseudomonas
fluorescens) 		4 / 5 PHE A 187
TYR A 350
LEU A 192
LYS A 191
 None
 1.15A 3sueC-4it1A:
undetectable		 3sueC-4it1A:
19.27
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.
3SUG_A_SUEA1201_2
(NS3 PROTEASE, NS4A
PROTEIN)		 4it1 PUTATIVE GLUCARATE
DEHYDRATASE
(Pseudomonas
fluorescens) 		4 / 5 PHE A 187
TYR A 350
LEU A 192
LYS A 191
 None
 1.27A 3sugA-4it1A:
undetectable		 3sugA-4it1A:
19.13
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.
4BUP_B_SAMB500_1
(HISTONE-LYSINE
N-METHYLTRANSFERASE
SUV420H1)		 4it1 PUTATIVE GLUCARATE
DEHYDRATASE
(Pseudomonas
fluorescens) 		3 / 3 HIS A 320
GLU A 246
ASN A 223
 None
MG  A 501 (-2.8A)
TLA  A 502 (-3.7A)
 0.89A 4bupB-4it1A:
undetectable		 4bupB-4it1A:
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.
4MJ8_A_SPMA202_1
(SPERMIDINE
N1-ACETYLTRANSFERASE)		 4it1 PUTATIVE GLUCARATE
DEHYDRATASE
(Pseudomonas
fluorescens) 		4 / 8 ILE A  43
GLU A  37
GLU A  35
ILE A 360
 None
 0.92A 4mj8A-4it1A:
undetectable		 4mj8A-4it1A:
17.54
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.
5DZK_O_BEZO801_0
(ATP-DEPENDENT CLP
PROTEASE PROTEOLYTIC
SUBUNIT 2
BEZ-LEU-LEU)		 4it1 PUTATIVE GLUCARATE
DEHYDRATASE
(Pseudomonas
fluorescens) 		4 / 6 SER A 101
HIS A 102
PRO A  99
LEU A  97
 None
None
TLA  A 502 (-4.3A)
None
 1.22A 5dzka-4it1A:
2.0
5dzko-4it1A:
undetectable		 5dzka-4it1A:
21.16
5dzko-4it1A:
4.88
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.
5GWX_A_SAMA301_1
(GLYCINE SARCOSINE
N-METHYLTRANSFERASE)		 4it1 PUTATIVE GLUCARATE
DEHYDRATASE
(Pseudomonas
fluorescens) 		3 / 3 ARG A 404
ASN A 322
ASP A 221
 TLA  A 502 (-2.9A)
TLA  A 502 ( 4.8A)
MG  A 501 (-2.6A)
 0.74A 5gwxA-4it1A:
undetectable		 5gwxA-4it1A:
20.61
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.
5MVM_A_PFLA510_1
(PROTON-GATED ION
CHANNEL)		 4it1 PUTATIVE GLUCARATE
DEHYDRATASE
(Pseudomonas
fluorescens) 		5 / 9 ILE A 182
ALA A 146
ILE A 190
ILE A 174
LEU A 209
 None
 1.09A 5mvmA-4it1A:
undetectable
5mvmE-4it1A:
undetectable		 5mvmA-4it1A:
12.59
5mvmE-4it1A:
12.59
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.
5UBB_A_SAMA301_1
(ALPHA N-TERMINAL
PROTEIN
METHYLTRANSFERASE 1B)		 4it1 PUTATIVE GLUCARATE
DEHYDRATASE
(Pseudomonas
fluorescens) 		4 / 5 GLY A  23
ARG A 423
ASP A 406
GLN A 403
 None
 1.38A 5ubbA-4it1A:
undetectable		 5ubbA-4it1A:
19.86
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.
5WBV_A_SAMA402_1
(HISTONE-LYSINE
N-METHYLTRANSFERASE
KMT5B)		 4it1 PUTATIVE GLUCARATE
DEHYDRATASE
(Pseudomonas
fluorescens) 		3 / 3 HIS A 320
GLU A 246
ASN A 223
 None
MG  A 501 (-2.8A)
TLA  A 502 (-3.7A)
 0.97A 5wbvA-4it1A:
undetectable		 5wbvA-4it1A:
22.15
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.
5WBV_B_SAMB402_1
(HISTONE-LYSINE
N-METHYLTRANSFERASE
KMT5B)		 4it1 PUTATIVE GLUCARATE
DEHYDRATASE
(Pseudomonas
fluorescens) 		3 / 3 HIS A 320
GLU A 246
ASN A 223
 None
MG  A 501 (-2.8A)
TLA  A 502 (-3.7A)
 0.97A 5wbvB-4it1A:
undetectable		 5wbvB-4it1A:
22.15
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.
6DJZ_A_GMJA301_1
(SIGMA NON-OPIOID
INTRACELLULAR
RECEPTOR 1)		 4it1 PUTATIVE GLUCARATE
DEHYDRATASE
(Pseudomonas
fluorescens) 		4 / 6 SER A 108
GLN A  81
GLU A 115
THR A 303
 None
 1.33A 6djzA-4it1A:
undetectable		 6djzA-4it1A:
19.31
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.
6QXS_D_FOZD403_0
(THYMIDYLATE SYNTHASE)		 4it1 PUTATIVE GLUCARATE
DEHYDRATASE
(Pseudomonas
fluorescens) 		5 / 12 LEU A 300
ASP A 120
LEU A  45
GLY A  44
ILE A 327
 None
 1.15A 6qxsD-4it1A:
undetectable		 6qxsD-4it1A:
20.48
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.
6R2E_C_FFOC404_0
(THYMIDYLATE SYNTHASE)		 4it1 PUTATIVE GLUCARATE
DEHYDRATASE
(Pseudomonas
fluorescens) 		5 / 10 ILE A  34
LEU A 300
ASP A 120
LEU A  45
GLY A  44
 None
 1.29A 6r2eC-4it1A:
undetectable		 6r2eC-4it1A:
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.
6R2E_H_FFOH403_0
(THYMIDYLATE SYNTHASE)		 4it1 PUTATIVE GLUCARATE
DEHYDRATASE
(Pseudomonas
fluorescens) 		5 / 12 ILE A  34
LEU A 300
ASP A 120
LEU A  45
GLY A  44
 None
 1.27A 6r2eH-4it1A:
undetectable		 6r2eH-4it1A:
22.22