SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '2haw'

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.
1ERE_E_ESTE600_1
(ESTROGEN RECEPTOR)		 2haw MANGANESE-DEPENDENT
INORGANIC
PYROPHOSPHATASE
(Bacillus
subtilis) 		4 / 8 ALA A  64
GLU A  67
LEU A   5
ARG A  59
 None
 0.92A 1ereE-2hawA:
undetectable		 1ereE-2hawA:
22.26
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.
1ERE_F_ESTF600_1
(ESTROGEN RECEPTOR)		 2haw MANGANESE-DEPENDENT
INORGANIC
PYROPHOSPHATASE
(Bacillus
subtilis) 		4 / 8 ALA A  64
GLU A  67
LEU A   5
ARG A  59
 None
 0.91A 1ereF-2hawA:
undetectable		 1ereF-2hawA:
22.26
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.
1G50_A_ESTA600_1
(ESTROGEN RECEPTOR)		 2haw MANGANESE-DEPENDENT
INORGANIC
PYROPHOSPHATASE
(Bacillus
subtilis) 		5 / 11 ALA A  64
GLU A  67
LEU A   5
ARG A  59
HIS A  76
 None
 1.18A 1g50A-2hawA:
undetectable		 1g50A-2hawA:
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.
2BXF_A_DZPA2001_1
(SERUM ALBUMIN)		 2haw MANGANESE-DEPENDENT
INORGANIC
PYROPHOSPHATASE
(Bacillus
subtilis) 		5 / 12 PHE A 250
LEU A 252
LEU A 234
VAL A 237
GLU A 198
 None
 1.20A 2bxfA-2hawA:
undetectable		 2bxfA-2hawA:
21.71
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.
2EJF_B_ADNB2002_1
(235AA LONG
HYPOTHETICAL
BIOTIN--[ACETYL-COA-
CARBOXYLASE] LIGASE)		 2haw MANGANESE-DEPENDENT
INORGANIC
PYROPHOSPHATASE
(Bacillus
subtilis) 		4 / 6 GLU A  35
ASN A  28
PRO A  36
ALA A  24
 None
 1.44A 2ejfB-2hawA:
undetectable		 2ejfB-2hawA:
25.16
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_A_SAMA2001_0
(PHENYLETHANOLAMINE
N-METHYLTRANSFERASE)		 2haw MANGANESE-DEPENDENT
INORGANIC
PYROPHOSPHATASE
(Bacillus
subtilis) 		5 / 12 LEU A 109
ASP A  96
VAL A  74
HIS A  76
ALA A  34
 None
 1.26A 2g70A-2hawA:
undetectable		 2g70A-2hawA:
21.56
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.
2G72_B_SAMB2002_0
(PHENYLETHANOLAMINE
N-METHYLTRANSFERASE)		 2haw MANGANESE-DEPENDENT
INORGANIC
PYROPHOSPHATASE
(Bacillus
subtilis) 		5 / 12 LEU A 109
ILE A  95
VAL A  74
HIS A  76
ALA A  34
 None
 1.24A 2g72B-2hawA:
undetectable		 2g72B-2hawA:
21.56
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.
2J2P_F_SC2F1291_1
(FICOLIN-2)		 2haw MANGANESE-DEPENDENT
INORGANIC
PYROPHOSPHATASE
(Bacillus
subtilis) 		4 / 6 LEU A 151
SER A 148
ASP A  13
ASP A  15
 None
MG  A1004 ( 4.5A)
MG  A1001 ( 2.0A)
MG  A1002 ( 3.3A)
 1.03A 2j2pE-2hawA:
undetectable
2j2pF-2hawA:
undetectable		 2j2pE-2hawA:
21.10
2j2pF-2hawA:
21.10
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.
3B6H_A_MXDA551_1
(PROSTACYCLIN
SYNTHASE)		 2haw MANGANESE-DEPENDENT
INORGANIC
PYROPHOSPHATASE
(Bacillus
subtilis) 		4 / 6 ALA A 166
LEU A 169
ALA A 120
THR A 119
 None
 0.89A 3b6hA-2hawA:
undetectable		 3b6hA-2hawA:
22.41
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.
3B6H_B_MXDB551_1
(PROSTACYCLIN
SYNTHASE)		 2haw MANGANESE-DEPENDENT
INORGANIC
PYROPHOSPHATASE
(Bacillus
subtilis) 		4 / 6 ALA A 166
LEU A 169
ALA A 120
THR A 119
 None
 0.87A 3b6hB-2hawA:
undetectable		 3b6hB-2hawA:
22.41
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.
3C0Z_A_SHHA301_1
(HISTONE DEACETYLASE
7A)		 2haw MANGANESE-DEPENDENT
INORGANIC
PYROPHOSPHATASE
(Bacillus
subtilis) 		4 / 5 HIS A  98
ASP A  75
HIS A  97
ASP A  15
 SO4  A4003 ( 3.8A)
MG  A1001 ( 2.4A)
MG  A1002 ( 3.5A)
MG  A1002 ( 3.3A)
 1.24A 3c0zA-2hawA:
undetectable		 3c0zA-2hawA:
22.55
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.
3RQW_C_ACHC323_0
(ELIC PENTAMERIC
LIGAND GATED ION
CHANNEL FROM ERWINIA
CHRYSANTHEMI)		 2haw MANGANESE-DEPENDENT
INORGANIC
PYROPHOSPHATASE
(Bacillus
subtilis) 		4 / 8 ASN A 130
GLU A  93
TYR A  23
LEU A  26
 PG4  A6002 (-3.5A)
PG4  A6002 (-3.3A)
None
None
 1.00A 3rqwC-2hawA:
undetectable
3rqwD-2hawA:
undetectable		 3rqwC-2hawA:
19.66
3rqwD-2hawA:
19.66
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.
3RQW_I_ACHI323_0
(ELIC PENTAMERIC
LIGAND GATED ION
CHANNEL FROM ERWINIA
CHRYSANTHEMI)		 2haw MANGANESE-DEPENDENT
INORGANIC
PYROPHOSPHATASE
(Bacillus
subtilis) 		4 / 8 ASN A 130
GLU A  93
TYR A  23
LEU A  26
 PG4  A6002 (-3.5A)
PG4  A6002 (-3.3A)
None
None
 1.02A 3rqwI-2hawA:
undetectable
3rqwJ-2hawA:
undetectable		 3rqwI-2hawA:
19.66
3rqwJ-2hawA:
19.66
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.
3RQW_J_ACHJ323_0
(ELIC PENTAMERIC
LIGAND GATED ION
CHANNEL FROM ERWINIA
CHRYSANTHEMI)		 2haw MANGANESE-DEPENDENT
INORGANIC
PYROPHOSPHATASE
(Bacillus
subtilis) 		4 / 8 GLU A  93
TYR A  23
LEU A  26
ASN A 130
 PG4  A6002 (-3.3A)
None
None
PG4  A6002 (-3.5A)
 1.02A 3rqwF-2hawA:
undetectable
3rqwJ-2hawA:
undetectable		 3rqwF-2hawA:
19.66
3rqwJ-2hawA:
19.66
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.
5EEI_A_SHHA2004_1
(HDAC6 PROTEIN)		 2haw MANGANESE-DEPENDENT
INORGANIC
PYROPHOSPHATASE
(Bacillus
subtilis) 		5 / 12 SER A 294
HIS A  98
ASP A  75
HIS A  97
ASP A  15
 2PN  A2001 ( 4.1A)
SO4  A4003 ( 3.8A)
MG  A1001 ( 2.4A)
MG  A1002 ( 3.5A)
MG  A1002 ( 3.3A)
 1.36A 5eeiA-2hawA:
undetectable		 5eeiA-2hawA:
21.30
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.
5EEI_B_SHHB801_1
(HDAC6 PROTEIN)		 2haw MANGANESE-DEPENDENT
INORGANIC
PYROPHOSPHATASE
(Bacillus
subtilis) 		5 / 12 SER A 294
HIS A  98
ASP A  75
HIS A  97
ASP A  15
 2PN  A2001 ( 4.1A)
SO4  A4003 ( 3.8A)
MG  A1001 ( 2.4A)
MG  A1002 ( 3.5A)
MG  A1002 ( 3.3A)
 1.37A 5eeiB-2hawA:
undetectable		 5eeiB-2hawA:
21.30
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.
5EEN_B_5OGB804_1
(HDAC6 PROTEIN)		 2haw MANGANESE-DEPENDENT
INORGANIC
PYROPHOSPHATASE
(Bacillus
subtilis) 		5 / 12 SER A 294
HIS A  98
ASP A  75
HIS A  97
ASP A  15
 2PN  A2001 ( 4.1A)
SO4  A4003 ( 3.8A)
MG  A1001 ( 2.4A)
MG  A1002 ( 3.5A)
MG  A1002 ( 3.3A)
 1.38A 5eenB-2hawA:
undetectable		 5eenB-2hawA:
21.30
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.
5EF8_A_LBHA2004_1
(HDAC6 PROTEIN)		 2haw MANGANESE-DEPENDENT
INORGANIC
PYROPHOSPHATASE
(Bacillus
subtilis) 		5 / 12 SER A 294
HIS A  98
ASP A  75
HIS A  97
ASP A  15
 2PN  A2001 ( 4.1A)
SO4  A4003 ( 3.8A)
MG  A1001 ( 2.4A)
MG  A1002 ( 3.5A)
MG  A1002 ( 3.3A)
 1.38A 5ef8A-2hawA:
undetectable		 5ef8A-2hawA:
21.30
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.
5EF8_B_LBHB2004_1
(HDAC6 PROTEIN)		 2haw MANGANESE-DEPENDENT
INORGANIC
PYROPHOSPHATASE
(Bacillus
subtilis) 		5 / 12 SER A 294
HIS A  98
ASP A  75
HIS A  97
ASP A  15
 2PN  A2001 ( 4.1A)
SO4  A4003 ( 3.8A)
MG  A1001 ( 2.4A)
MG  A1002 ( 3.5A)
MG  A1002 ( 3.3A)
 1.39A 5ef8B-2hawA:
undetectable		 5ef8B-2hawA:
21.30
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.
5JW1_B_CELB602_2
(PROSTAGLANDIN G/H
SYNTHASE 2)		 2haw MANGANESE-DEPENDENT
INORGANIC
PYROPHOSPHATASE
(Bacillus
subtilis) 		4 / 6 VAL A 302
VAL A 253
ILE A 238
PHE A 250
 None
 1.04A 5jw1B-2hawA:
undetectable		 5jw1B-2hawA:
19.10