SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '1j1w'

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.
1E7C_A_HLTA4007_1
(SERUM ALBUMIN)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		4 / 8 LEU A 610
PHE A 578
LEU A 617
LEU A 614
 None
 1.05A 1e7cA-1j1wA:
2.3		 1e7cA-1j1wA:
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.
1ERR_B_RALB600_1
(ESTROGEN RECEPTOR)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		5 / 12 TRP A 667
LEU A  23
ILE A  81
LEU A 614
LEU A 671
 None
 1.20A 1errB-1j1wA:
undetectable		 1errB-1j1wA:
16.67
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.
1F9G_A_ASCA950_0
(HYALURONATE LYASE)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		4 / 7 ASN A  85
TYR A 420
ARG A 139
ARG A 145
 NAP  A1000 (-4.0A)
None
NAP  A1000 ( 4.6A)
None
 1.30A 1f9gA-1j1wA:
undetectable		 1f9gA-1j1wA:
22.20
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.
1GSF_C_EAAC223_1
(GLUTATHIONE
TRANSFERASE A1-1)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		4 / 8 TYR A 323
LEU A 300
VAL A 293
PHE A 274
 None
 0.99A 1gsfC-1j1wA:
0.0		 1gsfC-1j1wA:
14.46
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.
1IE4_B_T44B328_1
(TRANSTHYRETIN)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		4 / 8 ALA A 673
LEU A 671
LYS A 639
ALA A 636
 None
 0.85A 1ie4B-1j1wA:
undetectable
1ie4D-1j1wA:
undetectable		 1ie4B-1j1wA:
9.99
1ie4D-1j1wA:
9.99
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.
1MF1_A_ACTA458_0
(ADENYLOSUCCINATE
SYNTHETASE)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		4 / 4 GLY A 368
LYS A 369
GLY A 365
HIS A 371
 None
 1.10A 1mf1A-1j1wA:
1.5		 1mf1A-1j1wA:
20.69
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.
1MT1_A_AG2A7005_1
(PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE BETA
CHAIN
PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE ALPHA
CHAIN)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		4 / 6 LEU A  69
LEU A  10
ILE A  62
GLU A  68
 None
 1.09A 1mt1A-1j1wA:
0.0
1mt1F-1j1wA:
0.0		 1mt1A-1j1wA:
6.18
1mt1F-1j1wA:
10.48
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.
1TYR_A_9CRA131_1
(TRANSTHYRETIN)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		4 / 6 LEU A 577
ALA A  73
SER A 573
THR A  74
 None
 1.16A 1tyrA-1j1wA:
3.3		 1tyrA-1j1wA:
10.31
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.
1TYR_A_9CRA131_1
(TRANSTHYRETIN)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		4 / 6 LEU A 577
LEU A 571
SER A 573
THR A  75
 None
 1.28A 1tyrA-1j1wA:
3.3		 1tyrA-1j1wA:
10.31
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.
2BYO_A_LNLA1216_1
(LIPOPROTEIN LPPX)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		4 / 5 LEU A 663
ILE A  25
LEU A  23
SER A  21
 None
 0.96A 2byoA-1j1wA:
0.0		 2byoA-1j1wA:
15.17
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.
2CML_B_ZMRB2477_1
(NEURAMINIDASE)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		5 / 12 ASP A 495
ALA A 417
GLU A 419
ASN A 544
TYR A 382
 None
 1.41A 2cmlB-1j1wA:
undetectable		 2cmlB-1j1wA:
20.17
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.
2CML_D_ZMRD4477_1
(NEURAMINIDASE)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		5 / 12 ASP A 495
ALA A 417
GLU A 419
ASN A 544
TYR A 382
 None
 1.41A 2cmlD-1j1wA:
undetectable		 2cmlD-1j1wA:
20.17
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.
2KCE_A_D16A566_2
(THYMIDYLATE SYNTHASE)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		3 / 3 HIS A 660
ILE A 640
LEU A 633
 None
 0.74A 2kceA-1j1wA:
undetectable		 2kceA-1j1wA:
16.01
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.
2MJI_A_KTRA201_1
(FATTY ACID-BINDING
PROTEIN, INTESTINAL)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		5 / 12 ILE A  25
THR A 632
LEU A 671
PHE A 684
LEU A 680
 None
 1.40A 2mjiA-1j1wA:
0.0		 2mjiA-1j1wA:
11.40
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.
2MJI_A_KTRA201_1
(FATTY ACID-BINDING
PROTEIN, INTESTINAL)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		5 / 12 ILE A  26
THR A 632
LEU A 671
PHE A 684
LEU A 680
 None
 1.30A 2mjiA-1j1wA:
0.0		 2mjiA-1j1wA:
11.40
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.
2Q6H_A_CXXA801_1
(TRANSPORTER)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		5 / 11 LEU A 663
GLN A 669
ILE A  25
PHE A  29
LEU A 737
 None
 1.25A 2q6hA-1j1wA:
0.1		 2q6hA-1j1wA:
21.59
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.
2QB4_A_DSMA801_1
(TRANSPORTER)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		5 / 12 LEU A 663
ILE A  25
ALA A 668
PHE A  29
LEU A 737
 None
 1.11A 2qb4A-1j1wA:
0.0		 2qb4A-1j1wA:
21.59
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.
2QEB_B_HSMB145_1
(D7R4 PROTEIN)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		4 / 7 ARG A 125
TYR A 126
ASP A 109
GLU A  54
 None
 1.13A 2qebB-1j1wA:
undetectable		 2qebB-1j1wA:
12.24
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.
2QEI_A_CXXA801_1
(TRANSPORTER)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		5 / 11 LEU A 663
GLN A 669
ILE A  25
PHE A  29
LEU A 737
 None
 1.27A 2qeiA-1j1wA:
0.0		 2qeiA-1j1wA:
21.59
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.
2QJU_A_DSMA801_1
(TRANSPORTER)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		5 / 11 LEU A 663
ILE A  25
ALA A 668
PHE A  29
LEU A 737
 None
 1.14A 2qjuA-1j1wA:
0.0		 2qjuA-1j1wA:
21.48
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.
2X2N_A_X2NA1480_1
(LANOSTEROL
14-ALPHA-DEMETHYLASE)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		5 / 12 TYR A 715
TYR A 716
PRO A  15
ALA A  18
ALA A  88
 None
 1.10A 2x2nA-1j1wA:
undetectable		 2x2nA-1j1wA:
20.74
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.
2ZJ0_C_2FAC500_2
(ADENOSYLHOMOCYSTEINA
SE)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		4 / 5 LEU A 671
GLN A 635
THR A 632
THR A 685
 None
 1.27A 2zj0C-1j1wA:
undetectable		 2zj0C-1j1wA:
22.24
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.
3A50_A_VD3A2001_1
(VITAMIN D
HYDROXYLASE)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		5 / 12 PRO A 718
ILE A  97
LEU A  44
ILE A  86
ALA A  88
 None
None
None
NAP  A1000 ( 4.2A)
None
 1.05A 3a50A-1j1wA:
0.0		 3a50A-1j1wA:
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.
3AOD_A_MIYA2001_1
(ACRIFLAVINE
RESISTANCE PROTEIN B)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		4 / 8 SER A 184
GLY A 433
ILE A 429
PHE A 427
 None
 0.75A 3aodA-1j1wA:
undetectable		 3aodA-1j1wA:
23.51
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.
3CCF_A_BEZA261_0
(CYCLOPROPANE-FATTY-A
CYL-PHOSPHOLIPID
SYNTHASE)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		4 / 8 GLY A 411
ASN A 409
TRP A 487
ARG A 547
 None
 1.05A 3ccfA-1j1wA:
undetectable		 3ccfA-1j1wA:
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.
3CFQ_A_DIFA1_1
(TRANSTHYRETIN)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		4 / 6 LEU A 577
ALA A  78
SER A 573
THR A  75
 None
 0.94A 3cfqA-1j1wA:
undetectable		 3cfqA-1j1wA:
9.57
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.
3CFQ_B_DIFB1_1
(TRANSTHYRETIN)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		4 / 7 LEU A 577
ALA A  78
SER A 573
THR A  75
 None
 1.04A 3cfqA-1j1wA:
undetectable
3cfqB-1j1wA:
undetectable		 3cfqA-1j1wA:
9.57
3cfqB-1j1wA:
9.57
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.
3EIG_A_MTXA200_2
(DIHYDROFOLATE
REDUCTASE)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		4 / 5 ARG A  40
ILE A  42
VAL A 137
THR A  75
 None
 0.93A 3eigA-1j1wA:
undetectable		 3eigA-1j1wA:
13.57
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.
3F33_A_PFLA2001_1
(FERRITIN LIGHT CHAIN)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		4 / 6 LEU A 610
SER A 613
LEU A 617
LEU A 633
 None
 1.02A 3f33A-1j1wA:
undetectable		 3f33A-1j1wA:
13.10
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.
3FL9_A_TOPA200_1
(DIHYDROFOLATE
REDUCTASE (DHFR))		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		5 / 10 ALA A  45
LEU A 100
ALA A 713
ILE A 712
LEU A  17
 None
 1.15A 3fl9A-1j1wA:
2.4		 3fl9A-1j1wA:
12.47
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.
3L4D_A_TPFA490_1
(STEROL 14-ALPHA
DEMETHYLASE)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		4 / 8 TYR A   8
ALA A 609
THR A 637
LEU A 663
 None
 0.96A 3l4dA-1j1wA:
undetectable		 3l4dA-1j1wA:
20.03
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.
3LN1_A_CELA682_2
(PROSTAGLANDIN G/H
SYNTHASE 2)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		4 / 8 LEU A 740
LEU A 629
ILE A 687
PHE A 684
 None
 0.90A 3ln1A-1j1wA:
0.0		 3ln1A-1j1wA:
22.76
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.
3LN1_B_CELB682_2
(PROSTAGLANDIN G/H
SYNTHASE 2)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		4 / 7 LEU A 740
LEU A 629
ILE A 687
PHE A 684
 None
 0.88A 3ln1B-1j1wA:
0.0		 3ln1B-1j1wA:
22.76
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.
3N8X_A_NIMA701_1
(PROSTAGLANDIN G/H
SYNTHASE 1)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		5 / 12 ARG A 145
TRP A 601
GLY A 581
ALA A 582
SER A 562
 None
NAP  A1000 (-3.2A)
None
None
None
 1.26A 3n8xA-1j1wA:
0.0		 3n8xA-1j1wA:
21.78
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.
3PGY_A_GLYA510_0
(SERINE
HYDROXYMETHYLTRANSFE
RASE)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		4 / 6 ILE A 236
GLU A 273
ALA A 238
ASN A 234
 None
 1.03A 3pgyA-1j1wA:
undetectable
3pgyB-1j1wA:
undetectable		 3pgyA-1j1wA:
20.16
3pgyB-1j1wA:
20.16
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.
3S3M_A_DLUA398_1
(PFV INTEGRASE)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		4 / 8 GLY A 583
PRO A 587
GLN A 591
GLU A  13
 NAP  A1000 (-4.8A)
NAP  A1000 (-4.6A)
None
NAP  A1000 ( 4.7A)
 0.89A 3s3mA-1j1wA:
undetectable		 3s3mA-1j1wA:
20.03
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.
3S3N_A_DLUA398_1
(PFV INTEGRASE)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		4 / 8 GLY A 583
PRO A 587
GLN A 591
GLU A  13
 NAP  A1000 (-4.8A)
NAP  A1000 (-4.6A)
None
NAP  A1000 ( 4.7A)
 0.92A 3s3nA-1j1wA:
undetectable		 3s3nA-1j1wA:
19.89
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.
3SUD_C_SUEC1201_1
(NS3 PROTEASE, NS4A
PROTEIN)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		5 / 12 ILE A 390
GLY A 397
ALA A 398
PHE A 399
ARG A 358
 None
 1.02A 3sudC-1j1wA:
undetectable		 3sudC-1j1wA:
14.21
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.
3UQ6_A_ADNA401_1
(ADENOSINE KINASE,
PUTATIVE)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		5 / 12 ASN A  79
ILE A 568
GLY A 574
GLY A 575
GLY A 141
 None
 0.95A 3uq6A-1j1wA:
undetectable		 3uq6A-1j1wA:
18.49
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.
3VAQ_A_ADNA401_1
(PUTATIVE ADENOSINE
KINASE)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		5 / 12 ASN A  79
ILE A 568
GLY A 574
GLY A 575
GLY A 141
 None
 0.89A 3vaqA-1j1wA:
undetectable		 3vaqA-1j1wA:
18.76
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.
3VAS_A_ADNA401_1
(PUTATIVE ADENOSINE
KINASE)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		5 / 12 ASN A  79
ILE A 568
GLY A 574
GLY A 575
GLY A 141
 None
 0.90A 3vasA-1j1wA:
undetectable		 3vasA-1j1wA:
18.63
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.
3VAS_B_ADNB401_1
(PUTATIVE ADENOSINE
KINASE)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		5 / 12 ASN A  79
ILE A 568
GLY A 574
GLY A 575
GLY A 141
 None
 0.91A 3vasB-1j1wA:
undetectable		 3vasB-1j1wA:
18.63
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.
3VRM_A_VD3A502_1
(VITAMIN D(3)
25-HYDROXYLASE)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		5 / 12 PRO A 718
ILE A  97
LEU A  44
ILE A  86
ALA A  88
 None
None
None
NAP  A1000 ( 4.2A)
None
 1.05A 3vrmA-1j1wA:
0.0		 3vrmA-1j1wA:
21.88
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.
4HB6_A_DXCA75_0
(PPCA)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		4 / 8 LEU A 279
ILE A 289
PHE A 291
GLY A 296
 None
 0.86A 4hb6A-1j1wA:
undetectable		 4hb6A-1j1wA:
7.54
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.
4IIL_A_RBFA401_1
(MEMBRANE LIPOPROTEIN
TPN38(B))		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		5 / 12 SER A  21
GLN A 706
ALA A 648
ASP A 602
ILE A 640
 None
 1.48A 4iilA-1j1wA:
5.3		 4iilA-1j1wA:
20.21
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.
4IKI_B_IMNB201_1
(TRANSTHYRETIN)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		4 / 6 LEU A 577
ALA A  78
SER A 573
THR A  75
 None
 0.98A 4ikiB-1j1wA:
2.9		 4ikiB-1j1wA:
10.31
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.
4IKJ_A_SUZA201_1
(TRANSTHYRETIN)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		4 / 7 LEU A 577
ALA A  78
SER A 573
THR A  75
 None
 0.99A 4ikjA-1j1wA:
undetectable
4ikjB-1j1wA:
undetectable		 4ikjA-1j1wA:
10.31
4ikjB-1j1wA:
10.31
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.
4IKJ_B_SUZB201_1
(TRANSTHYRETIN)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		4 / 8 LEU A 577
ALA A  78
SER A 573
THR A  75
 None
 1.00A 4ikjA-1j1wA:
undetectable
4ikjB-1j1wA:
undetectable		 4ikjA-1j1wA:
10.31
4ikjB-1j1wA:
10.31
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.
4IKK_B_SUZB201_1
(TRANSTHYRETIN)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		4 / 7 LEU A 577
ALA A  78
SER A 573
THR A  75
 None
 1.00A 4ikkA-1j1wA:
undetectable
4ikkB-1j1wA:
undetectable		 4ikkA-1j1wA:
10.31
4ikkB-1j1wA:
10.31
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.
4IKL_A_SUZA201_1
(TRANSTHYRETIN)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		4 / 7 LEU A 577
ALA A  78
SER A 573
THR A  75
 None
 1.00A 4iklA-1j1wA:
undetectable
4iklB-1j1wA:
2.9		 4iklA-1j1wA:
10.31
4iklB-1j1wA:
10.31
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.
4IQQ_A_D16A402_1
(THYMIDYLATE SYNTHASE)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		4 / 7 ASP A 655
GLY A 658
PHE A 661
TYR A 598
 None
 0.88A 4iqqA-1j1wA:
undetectable		 4iqqA-1j1wA:
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.
4IQQ_B_D16B402_1
(THYMIDYLATE SYNTHASE)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		4 / 7 ASP A 655
GLY A 658
PHE A 661
TYR A 598
 None
 0.87A 4iqqB-1j1wA:
0.0		 4iqqB-1j1wA:
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.
4IQQ_D_D16D402_1
(THYMIDYLATE SYNTHASE)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		4 / 8 ASP A 655
GLY A 658
PHE A 661
TYR A 598
 None
 0.86A 4iqqD-1j1wA:
undetectable		 4iqqD-1j1wA:
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.
4MM4_A_8PRA603_1
(TRANSPORTER)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		5 / 12 VAL A 385
ALA A 383
TYR A 386
PHE A 554
THR A 525
 None
 1.21A 4mm4A-1j1wA:
0.0		 4mm4A-1j1wA:
21.46
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.
4MM4_B_8PRB603_1
(TRANSPORTER)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		5 / 12 VAL A 385
ALA A 383
TYR A 386
PHE A 554
THR A 525
 None
 1.18A 4mm4B-1j1wA:
0.0		 4mm4B-1j1wA:
21.46
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.
4R3A_A_RBFA402_1
(BLUE-LIGHT-ACTIVATED
HISTIDINE KINASE 2)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		5 / 12 ALA A  28
ARG A 728
ALA A 735
ILE A 698
LEU A 691
 None
 1.18A 4r3aA-1j1wA:
undetectable		 4r3aA-1j1wA:
20.95
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.
4RET_A_DGXA1107_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		5 / 12 LEU A 680
LEU A  22
GLY A  31
GLU A 679
LEU A 617
 None
 1.15A 4retA-1j1wA:
0.1		 4retA-1j1wA:
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.
4RET_C_DGXC2005_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		5 / 12 LEU A 680
LEU A  22
GLY A  31
GLU A 679
LEU A 617
 None
 1.15A 4retC-1j1wA:
0.0		 4retC-1j1wA:
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.
4UUU_B_SAMB1548_0
(CYSTATHIONINE
BETA-SYNTHASE)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		5 / 11 SER A  87
ALA A 586
PRO A 587
THR A  11
ILE A  42
 NAP  A1000 (-4.1A)
NAP  A1000 (-3.8A)
NAP  A1000 (-4.6A)
None
None
 1.26A 4uuuB-1j1wA:
undetectable		 4uuuB-1j1wA:
12.33
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.
4X20_D_LOCD502_1
(TUBULIN ALPHA CHAIN
TUBULIN BETA CHAIN)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		3 / 3 SER A 171
ALA A 375
VAL A 376
 None
 0.59A 4x20C-1j1wA:
undetectable		 4x20C-1j1wA:
19.92
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.
4Y4J_A_LNRA412_1
(ENDOTHIAPEPSIN)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		5 / 9 ASP A 495
ASP A 489
TYR A 182
ASP A 379
SER A 225
 None
 1.42A 4y4jA-1j1wA:
undetectable		 4y4jA-1j1wA:
20.03
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.
5DPD_A_SAMA601_0
(PROTEIN LYSINE
METHYLTRANSFERASE 1)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		5 / 12 GLU A 606
GLY A 605
LEU A 566
SER A 567
VAL A 151
 None
 1.08A 5dpdA-1j1wA:
undetectable		 5dpdA-1j1wA:
20.50
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.
5ESF_A_TPFA602_1
(LANOSTEROL 14-ALPHA
DEMETHYLASE)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		4 / 8 ILE A  81
TYR A   8
THR A 637
LEU A 663
 None
 0.80A 5esfA-1j1wA:
2.2		 5esfA-1j1wA:
22.31
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.
5ESH_A_1YNA602_1
(LANOSTEROL 14-ALPHA
DEMETHYLASE)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		5 / 12 ALA A 735
ILE A  81
TYR A   8
THR A 637
LEU A 663
 None
 1.18A 5eshA-1j1wA:
undetectable		 5eshA-1j1wA:
22.18
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.
5ESK_A_1YNA701_2
(LANOSTEROL 14-ALPHA
DEMETHYLASE)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		4 / 4 ALA A  16
PRO A  24
LEU A 663
HIS A 660
 None
 1.36A 5eskA-1j1wA:
undetectable		 5eskA-1j1wA:
22.18
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.
5JWA_A_ACTA609_0
(NADH DEHYDROGENASE,
PUTATIVE)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		3 / 3 VAL A 226
SER A 225
TRP A 456
 None
 1.04A 5jwaA-1j1wA:
0.0		 5jwaA-1j1wA:
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.
5M0O_C_EPAC502_1
(TERMINAL
OLEFIN-FORMING FATTY
ACID DECARBOXYLASE)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		4 / 8 LEU A 550
PHE A 554
PRO A 521
ALA A 524
 None
 0.96A 5m0oC-1j1wA:
0.0		 5m0oC-1j1wA:
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.
5NOO_A_D16A402_1
(THYMIDYLATE SYNTHASE)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		4 / 7 ASP A 655
GLY A 658
PHE A 661
TYR A 598
 None
 0.85A 5nooA-1j1wA:
0.0		 5nooA-1j1wA:
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.
5NOO_B_D16B402_1
(THYMIDYLATE SYNTHASE)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		4 / 7 ASP A 655
GLY A 658
PHE A 661
TYR A 598
 None
 0.88A 5nooB-1j1wA:
0.0		 5nooB-1j1wA:
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.
5NOO_C_D16C402_1
(THYMIDYLATE SYNTHASE)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		4 / 6 ASP A 655
GLY A 658
PHE A 661
TYR A 598
 None
 0.88A 5nooC-1j1wA:
undetectable		 5nooC-1j1wA:
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.
5NOO_D_D16D402_1
(THYMIDYLATE SYNTHASE)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		4 / 8 ASP A 655
GLY A 658
PHE A 661
TYR A 598
 None
 0.86A 5nooD-1j1wA:
undetectable		 5nooD-1j1wA:
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.
5TE8_C_08JC602_1
(CYTOCHROME P450 3A4)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		5 / 7 ARG A 139
LEU A 577
THR A   9
ILE A  42
LEU A  69
 NAP  A1000 ( 4.6A)
None
None
None
None
 1.09A 5te8C-1j1wA:
1.5		 5te8C-1j1wA:
21.36
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.
5VLM_B_CVIB301_0
(REGULATORY PROTEIN
TETR)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		5 / 12 ALA A  67
GLU A 140
LEU A  72
ILE A  80
VAL A 134
 None
 1.26A 5vlmB-1j1wA:
0.5		 5vlmB-1j1wA:
13.84
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.
5X24_A_LSNA502_1
(CYTOCHROME P450 2C9)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		5 / 12 ALA A 278
PHE A 274
VAL A 293
GLY A 296
LEU A 329
 None
 1.19A 5x24A-1j1wA:
0.0		 5x24A-1j1wA:
21.62
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.
5X5Q_B_D16B402_1
(THYMIDYLATE SYNTHASE)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		5 / 12 ILE A 698
ASP A 655
GLY A 658
PHE A 661
ALA A 705
 None
 1.02A 5x5qB-1j1wA:
0.0		 5x5qB-1j1wA:
18.70
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.
5X5Q_B_D16B402_1
(THYMIDYLATE SYNTHASE)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		5 / 12 ILE A 698
ASP A 655
GLY A 658
PHE A 661
MET A 727
 None
 0.94A 5x5qB-1j1wA:
0.0		 5x5qB-1j1wA:
18.70
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.
6B0I_B_TA1B502_1
(TUBULIN BETA CHAIN)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		5 / 12 VAL A 485
ALA A 524
SER A 528
GLY A 543
LEU A 546
 None
 1.01A 6b0iB-1j1wA:
2.1		 6b0iB-1j1wA:
8.95
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.
6ECF_I_DVAI3010_0
(VLM2
DODECADEPSIPEPTIDE)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		3 / 3 PHE A 733
ARG A 728
ALA A  28
 None
 0.99A 6ecfB-1j1wA:
undetectable		 6ecfB-1j1wA:
17.95
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.
6HZP_A_FVTA501_0
(PEPTIDE ABC
TRANSPORTER PERMEASE)		 1j1w ISOCITRATE
DEHYDROGENASE
(Azotobacter
vinelandii) 		4 / 8 VAL A 293
ASN A 294
PRO A 264
ILE A 265
 None
 1.09A 6hzpA-1j1wA:
0.6		 6hzpA-1j1wA:
20.96