SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3ibg'

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.
2OD9_A_NCAA3721_0
(NAD-DEPENDENT
DEACETYLASE HST2)		 3ibg ATPASE, SUBUNIT OF
THE GET COMPLEX
(Aspergillus
fumigatus) 		3 / 3 PHE A 230
PHE A 168
PHE A 140
 None
 0.69A 2od9A-3ibgA:
1.7		 2od9A-3ibgA:
26.01
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.
2QQG_A_NCAA3721_0
(NAD-DEPENDENT
DEACETYLASE HST2)		 3ibg ATPASE, SUBUNIT OF
THE GET COMPLEX
(Aspergillus
fumigatus) 		3 / 3 PHE A 230
PHE A 168
PHE A 140
 None
 0.69A 2qqgA-3ibgA:
1.7		 2qqgA-3ibgA:
26.01
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.
2VL2_B_BEZB1162_0
(PEROXIREDOXIN-5)		 3ibg ATPASE, SUBUNIT OF
THE GET COMPLEX
(Aspergillus
fumigatus) 		4 / 7 THR A 159
GLY A  32
LEU A 169
PHE A 168
 None
 1.02A 2vl2B-3ibgA:
undetectable		 2vl2B-3ibgA:
19.65
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.
3JB2_A_SAMA1101_1
(STRUCTURAL PROTEIN
VP3)		 3ibg ATPASE, SUBUNIT OF
THE GET COMPLEX
(Aspergillus
fumigatus) 		3 / 3 GLU A  93
ASP A 158
ASP A  70
 None
 0.78A 3jb2A-3ibgA:
undetectable		 3jb2A-3ibgA:
15.91
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.
3UQ6_B_ADNB401_2
(ADENOSINE KINASE,
PUTATIVE)		 3ibg ATPASE, SUBUNIT OF
THE GET COMPLEX
(Aspergillus
fumigatus) 		4 / 5 LEU A 259
GLY A 263
PHE A  30
ASN A 227
 None
 1.25A 3uq6B-3ibgA:
undetectable		 3uq6B-3ibgA:
21.60
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.
4AZT_A_SAMA1472_0
(METHYLTRANSFERASE
WBDD)		 3ibg ATPASE, SUBUNIT OF
THE GET COMPLEX
(Aspergillus
fumigatus) 		5 / 12 ALA A  51
ASN A  88
ILE A 155
LEU A  46
ILE A  60
 None
 1.04A 4aztA-3ibgA:
undetectable		 4aztA-3ibgA:
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.
4C49_A_HCYA1384_1
(CORTICOSTEROID-BINDI
NG GLOBULIN)		 3ibg ATPASE, SUBUNIT OF
THE GET COMPLEX
(Aspergillus
fumigatus) 		5 / 12 ALA A  91
SER A  90
VAL A  83
THR A  41
ILE A  48
 None
None
None
ADP  A 349 (-3.6A)
None
 1.26A 4c49A-3ibgA:
undetectable		 4c49A-3ibgA:
22.66
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.
4EJJ_A_NCTA501_1
(CYTOCHROME P450 2A6)		 3ibg ATPASE, SUBUNIT OF
THE GET COMPLEX
(Aspergillus
fumigatus) 		4 / 7 PHE A 168
PHE A  30
THR A 236
ILE A 264
 None
 0.92A 4ejjA-3ibgA:
undetectable		 4ejjA-3ibgA:
22.36
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.
4NED_A_PFNA709_1
(LACTOTRANSFERRIN)		 3ibg ATPASE, SUBUNIT OF
THE GET COMPLEX
(Aspergillus
fumigatus) 		4 / 6 VAL A  31
ASP A 158
ALA A  71
PHE A  72
 None
 1.24A 4nedA-3ibgA:
undetectable		 4nedA-3ibgA:
23.77
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.
4QDC_A_ASDA404_1
(3-KETOSTEROID
9ALPHA-HYDROXYLASE
OXYGENASE)		 3ibg ATPASE, SUBUNIT OF
THE GET COMPLEX
(Aspergillus
fumigatus) 		5 / 12 VAL A 333
GLN A  49
LEU A  89
LEU A 325
PHE A  72
 None
 1.46A 4qdcA-3ibgA:
undetectable		 4qdcA-3ibgA:
22.36
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.
4ZE0_A_VORA602_1
(LANOSTEROL 14-ALPHA
DEMETHYLASE)		 3ibg ATPASE, SUBUNIT OF
THE GET COMPLEX
(Aspergillus
fumigatus) 		5 / 9 THR A 266
ILE A 256
GLY A  32
THR A 159
LEU A 169
 None
 1.24A 4ze0A-3ibgA:
undetectable		 4ze0A-3ibgA:
21.77
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.
5ZWR_B_9KLB402_0
(EST-Y29)		 3ibg ATPASE, SUBUNIT OF
THE GET COMPLEX
(Aspergillus
fumigatus) 		5 / 12 SER A  43
ILE A  60
LEU A  58
ALA A  47
LEU A  89
 None
 1.38A 5zwrB-3ibgA:
undetectable		 5zwrB-3ibgA:
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.
6BER_A_DVAA2_0
(E(DVA)DP(DGL)(DHI)(D
PR)N(DAL)(DPR))		 3ibg ATPASE, SUBUNIT OF
THE GET COMPLEX
(Aspergillus
fumigatus) 		3 / 3 GLU A  93
ASP A  95
PRO A  96
 None
 0.68A 6berA-3ibgA:
undetectable		 6berA-3ibgA:
6.08
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.
6E43_A_BEZA502_0
(INDOLEAMINE
2,3-DIOXYGENASE 1)		 3ibg ATPASE, SUBUNIT OF
THE GET COMPLEX
(Aspergillus
fumigatus) 		4 / 6 PHE A 328
VAL A 241
LEU A  17
LEU A 332
 ADP  A 349 (-4.5A)
None
None
None
 0.89A 6e43A-3ibgA:
1.7		 6e43A-3ibgA:
23.95
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.
6E43_B_BEZB502_0
(INDOLEAMINE
2,3-DIOXYGENASE 1)		 3ibg ATPASE, SUBUNIT OF
THE GET COMPLEX
(Aspergillus
fumigatus) 		4 / 6 PHE A 328
VAL A 241
LEU A  17
LEU A 332
 ADP  A 349 (-4.5A)
None
None
None
 0.90A 6e43B-3ibgA:
undetectable		 6e43B-3ibgA:
23.95
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.
6E43_C_BEZC502_0
(INDOLEAMINE
2,3-DIOXYGENASE 1)		 3ibg ATPASE, SUBUNIT OF
THE GET COMPLEX
(Aspergillus
fumigatus) 		4 / 6 PHE A 328
VAL A 241
LEU A  17
LEU A 332
 ADP  A 349 (-4.5A)
None
None
None
 0.89A 6e43C-3ibgA:
2.2		 6e43C-3ibgA:
23.95
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.
6E43_D_BEZD502_0
(INDOLEAMINE
2,3-DIOXYGENASE 1)		 3ibg ATPASE, SUBUNIT OF
THE GET COMPLEX
(Aspergillus
fumigatus) 		4 / 6 PHE A 328
VAL A 241
LEU A  17
LEU A 332
 ADP  A 349 (-4.5A)
None
None
None
 0.91A 6e43D-3ibgA:
undetectable		 6e43D-3ibgA:
23.95