SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '1o1j'

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.
1DMA_B_NCAB700_0
(EXOTOXIN A)		 1o1j HEMOGLOBIN ALPHA
CHAIN
(Homo
sapiens) 		4 / 6 HIS A 192
GLY A 193
ALA A 168
GLU A 165
 None
 1.02A 1dmaB-1o1jA:
undetectable		 1dmaB-1o1jA:
20.13
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.
1E7C_A_HLTA4007_1
(SERUM ALBUMIN)		 1o1j HEMOGLOBIN ALPHA
CHAIN
(Homo
sapiens) 		4 / 8 LEU A 247
ASP A 268
LEU A 267
LEU A 271
 None
 1.07A 1e7cA-1o1jA:
2.6		 1e7cA-1o1jA:
19.25
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1IWH_A_PEMA501_1
(HEMOGLOBIN ALPHA
CHAIN)		 1o1j HEMOGLOBIN ALPHA
CHAIN
(Homo
sapiens) 		4 / 6 LYS A  61
ASP A  64
ALA A  65
LEU A  83
 HEM  A 284 (-3.7A)
None
HEM  A 284 ( 4.0A)
HEM  A 284 (-4.4A)
 0.43A 1iwhA-1o1jA:
26.8		 1iwhA-1o1jA:
43.46
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.
1LH6_A_NIOA155_1
(LEGHEMOGLOBIN A
(NICOTINATE MET))		 1o1j HEMOGLOBIN ALPHA
CHAIN
(Homo
sapiens) 		4 / 7 PHE A  43
PHE A  46
VAL A  62
HIS A  87
 HEM  A 284 (-4.1A)
HEM  A 284 (-4.7A)
HEM  A 284 ( 4.1A)
HEM  A 284 (-3.3A)
 0.88A 1lh6A-1o1jA:
14.0		 1lh6A-1o1jA:
24.52
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.
1LH6_A_NIOA155_1
(LEGHEMOGLOBIN A
(NICOTINATE MET))		 1o1j HEMOGLOBIN ALPHA
CHAIN
(Homo
sapiens) 		4 / 7 PHE A 185
PHE A 188
VAL A 204
HIS A 229
 HEM  A 285 (-4.1A)
None
HEM  A 285 ( 4.1A)
HEM  A 285 (-3.3A)
 0.92A 1lh6A-1o1jA:
14.0		 1lh6A-1o1jA:
24.52
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.
2XCT_X_CPFX1020_1
(DNA GYRASE SUBUNIT
B, DNA GYRASE
SUBUNIT A)		 1o1j HEMOGLOBIN ALPHA
CHAIN
(Homo
sapiens) 		4 / 4 ARG A  31
GLY A  25
GLU A  27
SER A 133
 None
 1.15A 2xctS-1o1jA:
undetectable
2xctU-1o1jA:
undetectable		 2xctS-1o1jA:
18.42
2xctU-1o1jA:
18.42
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_X_CPFX1020_1
(DNA GYRASE SUBUNIT
B, DNA GYRASE
SUBUNIT A)		 1o1j HEMOGLOBIN ALPHA
CHAIN
(Homo
sapiens) 		4 / 4 ARG A 173
GLY A 167
GLU A 169
SER A 275
 None
 1.12A 2xctS-1o1jA:
undetectable
2xctU-1o1jA:
undetectable		 2xctS-1o1jA:
18.42
2xctU-1o1jA:
18.42
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.
3L8L_A_DVAA6_0
(GRAMICIDIN D)		 1o1j HEMOGLOBIN ALPHA
CHAIN
(Homo
sapiens) 		3 / 3 ALA A  19
VAL A  17
TRP A  14
 None
 0.84A 3l8lA-1o1jA:
undetectable
3l8lB-1o1jA:
undetectable		 3l8lA-1o1jA:
3.37
3l8lB-1o1jA:
4.17
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.
3SMT_A_ACTA500_0
(HISTONE-LYSINE
N-METHYLTRANSFERASE
SETD3)		 1o1j HEMOGLOBIN ALPHA
CHAIN
(Homo
sapiens) 		3 / 3 PHE A  46
SER A  52
GLN A  54
 HEM  A 284 (-4.7A)
None
None
 0.85A 3smtA-1o1jA:
0.0		 3smtA-1o1jA:
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.
3SMT_A_ACTA500_0
(HISTONE-LYSINE
N-METHYLTRANSFERASE
SETD3)		 1o1j HEMOGLOBIN ALPHA
CHAIN
(Homo
sapiens) 		3 / 3 PHE A 188
SER A 194
GLN A 196
 None
 0.80A 3smtA-1o1jA:
0.0		 3smtA-1o1jA:
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.
4M2V_A_BZ1A302_2
(CARBONIC ANHYDRASE 2)		 1o1j HEMOGLOBIN ALPHA
CHAIN
(Homo
sapiens) 		3 / 3 HIS A 122
VAL A  17
LEU A 113
 None
 0.70A 4m2vA-1o1jA:
undetectable		 4m2vA-1o1jA:
22.40
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5X2S_I_PEMI202_1
(HEMOGLOBIN SUBUNIT
ALPHA
HEMOGLOBIN SUBUNIT
BETA)		 1o1j HEMOGLOBIN ALPHA
CHAIN
(Homo
sapiens) 		5 / 8 PRO A  95
THR A 134
THR A 137
TYR A 140
PRO A 237
 None
 0.95A 5x2sI-1o1jA:
26.8
5x2sJ-1o1jA:
21.6
5x2sK-1o1jA:
27.5		 5x2sI-1o1jA:
98.58
5x2sJ-1o1jA:
24.48
5x2sK-1o1jA:
98.58
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5X2S_I_PEMI202_1
(HEMOGLOBIN SUBUNIT
ALPHA
HEMOGLOBIN SUBUNIT
BETA)		 1o1j HEMOGLOBIN ALPHA
CHAIN
(Homo
sapiens) 		4 / 8 PRO A 237
THR A 276
THR A 279
PRO A  95
 None
 0.53A 5x2sI-1o1jA:
26.8
5x2sJ-1o1jA:
21.6
5x2sK-1o1jA:
27.5		 5x2sI-1o1jA:
98.58
5x2sJ-1o1jA:
24.48
5x2sK-1o1jA:
98.58
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5X2S_I_PEMI202_1
(HEMOGLOBIN SUBUNIT
ALPHA
HEMOGLOBIN SUBUNIT
BETA)		 1o1j HEMOGLOBIN ALPHA
CHAIN
(Homo
sapiens) 		4 / 8 PRO A 237
THR A 276
THR A 279
TYR A 282
 None
 0.71A 5x2sI-1o1jA:
26.8
5x2sJ-1o1jA:
21.6
5x2sK-1o1jA:
27.5		 5x2sI-1o1jA:
98.58
5x2sJ-1o1jA:
24.48
5x2sK-1o1jA:
98.58
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5X2T_I_PEMI202_1
(HEMOGLOBIN SUBUNIT
ALPHA
HEMOGLOBIN SUBUNIT
BETA)		 1o1j HEMOGLOBIN ALPHA
CHAIN
(Homo
sapiens) 		5 / 8 PRO A  95
ALA A 130
THR A 134
THR A 137
ALA A 272
 None
 0.28A 5x2tI-1o1jA:
27.2
5x2tJ-1o1jA:
21.4
5x2tK-1o1jA:
27.3
5x2tL-1o1jA:
20.3		 5x2tI-1o1jA:
98.58
5x2tJ-1o1jA:
24.48
5x2tK-1o1jA:
98.58
5x2tL-1o1jA:
24.48
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5X2T_I_PEMI202_1
(HEMOGLOBIN SUBUNIT
ALPHA
HEMOGLOBIN SUBUNIT
BETA)		 1o1j HEMOGLOBIN ALPHA
CHAIN
(Homo
sapiens) 		5 / 8 PRO A 237
ALA A 272
THR A 276
THR A 279
ALA A 130
 None
 0.31A 5x2tI-1o1jA:
27.2
5x2tJ-1o1jA:
21.4
5x2tK-1o1jA:
27.3
5x2tL-1o1jA:
20.3		 5x2tI-1o1jA:
98.58
5x2tJ-1o1jA:
24.48
5x2tK-1o1jA:
98.58
5x2tL-1o1jA:
24.48