SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4a69'

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.
1ACJ_A_THAA999_1
(ACETYLCHOLINESTERASE)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		5 / 9 GLY A 143
TYR A 107
ILE A 150
HIS A 134
GLY A 176
 None
None
None
ACT  A 501 (-4.0A)
None
 1.41A 1acjA-4a69A:
undetectable		 1acjA-4a69A:
23.19
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1C3S_A_SHHA952_1
(HDLP (HISTONE
DEACETYLASE-LIKE
PROTEIN))		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		5 / 11 HIS A 135
HIS A 172
ASP A 259
LEU A 266
TYR A 298
 ACT  A 501 (-3.7A)
ZN  A 500 (-3.1A)
ZN  A 500 ( 2.4A)
None
ACT  A 501 (-4.7A)
 1.02A 1c3sA-4a69A:
47.6		 1c3sA-4a69A:
34.35
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1C3S_A_SHHA952_1
(HDLP (HISTONE
DEACETYLASE-LIKE
PROTEIN))		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		10 / 11 PRO A  23
HIS A 134
HIS A 135
PHE A 144
ASP A 170
HIS A 172
PHE A 200
ASP A 259
LEU A 266
TYR A 298
 None
ACT  A 501 (-4.0A)
ACT  A 501 (-3.7A)
None
ZN  A 500 (-2.2A)
ZN  A 500 (-3.1A)
None
ZN  A 500 ( 2.4A)
None
ACT  A 501 (-4.7A)
 0.44A 1c3sA-4a69A:
47.6		 1c3sA-4a69A:
34.35
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1C3S_A_SHHA952_1
(HDLP (HISTONE
DEACETYLASE-LIKE
PROTEIN))		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		5 / 11 TYR A 146
HIS A 134
HIS A 172
ASP A 259
TYR A 298
 None
ACT  A 501 (-4.0A)
ZN  A 500 (-3.1A)
ZN  A 500 ( 2.4A)
ACT  A 501 (-4.7A)
 1.38A 1c3sA-4a69A:
47.6		 1c3sA-4a69A:
34.35
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.
1EKJ_C_ACTC3004_0
(BETA-CARBONIC
ANHYDRASE)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		4 / 6 GLN A 255
TYR A 166
ASP A 170
GLY A 174
 None
None
ZN  A 500 (-2.2A)
None
 1.25A 1ekjC-4a69A:
1.7
1ekjD-4a69A:
undetectable		 1ekjC-4a69A:
20.37
1ekjD-4a69A:
20.37
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.
1EKJ_C_ACTC3007_0
(BETA-CARBONIC
ANHYDRASE)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		4 / 6 ASP A 170
GLY A 174
GLN A 255
TYR A 166
 ZN  A 500 (-2.2A)
None
None
None
 1.22A 1ekjC-4a69A:
undetectable
1ekjD-4a69A:
undetectable		 1ekjC-4a69A:
20.37
1ekjD-4a69A:
20.37
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.
1EKJ_E_ACTE3005_0
(BETA-CARBONIC
ANHYDRASE)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		4 / 7 ASP A 170
HIS A 134
GLY A 295
GLY A 294
 ZN  A 500 (-2.2A)
ACT  A 501 (-4.0A)
None
None
 1.00A 1ekjE-4a69A:
undetectable
1ekjF-4a69A:
undetectable		 1ekjE-4a69A:
20.37
1ekjF-4a69A:
20.37
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.
1EQB_A_FFOA1293_2
(SERINE
HYDROXYMETHYLTRANSFE
RASE)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		3 / 3 SER A 320
GLU A 321
GLU A 322
 None
 0.43A 1eqbD-4a69A:
3.7		 1eqbD-4a69A:
21.83
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.
1EQB_C_FFOC3293_0
(SERINE
HYDROXYMETHYLTRANSFE
RASE)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		3 / 3 SER A 320
GLU A 321
GLU A 322
 None
 0.43A 1eqbB-4a69A:
3.7		 1eqbB-4a69A:
21.83
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.
1MXG_A_ACRA442_1
(ALPHA AMYLASE)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		5 / 11 GLY A 143
PRO A  23
GLY A 296
GLY A 297
ASP A 259
 None
None
ACT  A 501 (-3.0A)
None
ZN  A 500 ( 2.4A)
 1.11A 1mxgA-4a69A:
undetectable		 1mxgA-4a69A:
20.47
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.
1MXG_A_ACRA444_1
(ALPHA AMYLASE)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		4 / 7 TYR A   7
TRP A 129
HIS A 276
GLY A 296
 None
None
None
ACT  A 501 (-3.0A)
 1.02A 1mxgA-4a69A:
undetectable		 1mxgA-4a69A:
20.47
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.
1MXG_A_ACRA444_1
(ALPHA AMYLASE)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		4 / 7 TYR A   7
TRP A 129
HIS A 276
GLY A 297
 None
 1.07A 1mxgA-4a69A:
undetectable		 1mxgA-4a69A:
20.47
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.
1ONI_A_BEZA502_0
(14.5 KDA
TRANSLATIONAL
INHIBITOR PROTEIN)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		4 / 6 ASN A 119
ARG A  60
ILE A 154
GLY A 153
 GOL  A 506 (-3.5A)
None
None
None
 0.99A 1oniA-4a69A:
undetectable
1oniB-4a69A:
undetectable		 1oniA-4a69A:
16.30
1oniB-4a69A:
16.30
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.
1ONI_D_BEZD508_0
(14.5 KDA
TRANSLATIONAL
INHIBITOR PROTEIN)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		4 / 6 ASN A 119
ARG A  60
ILE A 154
GLY A 153
 GOL  A 506 (-3.5A)
None
None
None
 1.02A 1oniD-4a69A:
undetectable
1oniF-4a69A:
0.5		 1oniD-4a69A:
16.30
1oniF-4a69A:
16.30
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1T69_A_SHHA379_1
(HISTONE DEACETYLASE
8)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		10 / 12 ASP A  93
HIS A 134
HIS A 135
GLY A 143
PHE A 144
ASP A 170
HIS A 172
PHE A 200
ASP A 259
TYR A 298
 None
ACT  A 501 (-4.0A)
ACT  A 501 (-3.7A)
None
None
ZN  A 500 (-2.2A)
ZN  A 500 (-3.1A)
None
ZN  A 500 ( 2.4A)
ACT  A 501 (-4.7A)
 0.32A 1t69A-4a69A:
55.2		 1t69A-4a69A:
40.98
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1T69_A_SHHA379_1
(HISTONE DEACETYLASE
8)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		5 / 12 TYR A 146
HIS A 134
HIS A 172
ASP A 259
TYR A 298
 None
ACT  A 501 (-4.0A)
ZN  A 500 (-3.1A)
ZN  A 500 ( 2.4A)
ACT  A 501 (-4.7A)
 1.37A 1t69A-4a69A:
55.2		 1t69A-4a69A:
40.98
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.
1UAK_A_SAMA301_0
(TRNA
(GUANINE-N(1)-)-METH
YLTRANSFERASE)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		6 / 12 GLY A 257
ILE A 150
VAL A 292
LEU A 293
GLY A 294
GLY A 295
 None
 1.28A 1uakA-4a69A:
undetectable		 1uakA-4a69A:
20.72
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.
1UAK_A_SAMA301_0
(TRNA
(GUANINE-N(1)-)-METH
YLTRANSFERASE)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		6 / 12 GLY A 296
ILE A 150
VAL A 292
LEU A 293
GLY A 294
GLY A 295
 ACT  A 501 (-3.0A)
None
None
None
None
None
 1.46A 1uakA-4a69A:
undetectable		 1uakA-4a69A:
20.72
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.
1ZZ1_A_SHHA2452_1
(HISTONE
DEACETYLASE-LIKE
AMIDOHYDROLASE)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		5 / 11 HIS A 134
HIS A 135
PHE A 144
ASP A 170
GLY A 295
 ACT  A 501 (-4.0A)
ACT  A 501 (-3.7A)
None
ZN  A 500 (-2.2A)
None
 1.12A 1zz1A-4a69A:
43.9		 1zz1A-4a69A:
26.42
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.
1ZZ1_A_SHHA2452_1
(HISTONE
DEACETYLASE-LIKE
AMIDOHYDROLASE)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		9 / 11 HIS A 134
HIS A 135
PHE A 144
ASP A 170
HIS A 172
PHE A 200
ASP A 259
GLY A 296
TYR A 298
 ACT  A 501 (-4.0A)
ACT  A 501 (-3.7A)
None
ZN  A 500 (-2.2A)
ZN  A 500 (-3.1A)
None
ZN  A 500 ( 2.4A)
ACT  A 501 (-3.0A)
ACT  A 501 (-4.7A)
 0.57A 1zz1A-4a69A:
43.9		 1zz1A-4a69A:
26.42
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.
1ZZ1_A_SHHA2452_1
(HISTONE
DEACETYLASE-LIKE
AMIDOHYDROLASE)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		5 / 11 HIS A 134
HIS A 172
ASP A 259
GLY A 296
TYR A 298
 ACT  A 501 (-4.0A)
ZN  A 500 (-3.1A)
ZN  A 500 ( 2.4A)
ACT  A 501 (-3.0A)
ACT  A 501 (-4.7A)
 1.04A 1zz1A-4a69A:
43.9		 1zz1A-4a69A:
26.42
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.
1ZZ1_A_SHHA2452_1
(HISTONE
DEACETYLASE-LIKE
AMIDOHYDROLASE)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		5 / 11 LEU A  29
HIS A 134
ASP A 170
ASP A 259
GLY A 257
 None
ACT  A 501 (-4.0A)
ZN  A 500 (-2.2A)
ZN  A 500 ( 2.4A)
None
 1.25A 1zz1A-4a69A:
43.9		 1zz1A-4a69A:
26.42
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.
1ZZ1_B_SHHB2552_1
(HISTONE
DEACETYLASE-LIKE
AMIDOHYDROLASE)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		9 / 12 HIS A 134
HIS A 135
PHE A 144
ASP A 170
HIS A 172
PHE A 200
ASP A 259
GLY A 296
TYR A 298
 ACT  A 501 (-4.0A)
ACT  A 501 (-3.7A)
None
ZN  A 500 (-2.2A)
ZN  A 500 (-3.1A)
None
ZN  A 500 ( 2.4A)
ACT  A 501 (-3.0A)
ACT  A 501 (-4.7A)
 0.51A 1zz1B-4a69A:
44.2
1zz1C-4a69A:
44.1		 1zz1B-4a69A:
26.42
1zz1C-4a69A:
26.42
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.
1ZZ1_B_SHHB2552_1
(HISTONE
DEACETYLASE-LIKE
AMIDOHYDROLASE)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		5 / 12 HIS A 134
HIS A 172
ASP A 259
GLY A 296
TYR A 298
 ACT  A 501 (-4.0A)
ZN  A 500 (-3.1A)
ZN  A 500 ( 2.4A)
ACT  A 501 (-3.0A)
ACT  A 501 (-4.7A)
 1.01A 1zz1B-4a69A:
44.2
1zz1C-4a69A:
44.1		 1zz1B-4a69A:
26.42
1zz1C-4a69A:
26.42
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.
1ZZ1_C_SHHC2652_1
(HISTONE
DEACETYLASE-LIKE
AMIDOHYDROLASE)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		5 / 12 HIS A 134
HIS A 135
GLY A 143
ASP A 170
GLY A 295
 ACT  A 501 (-4.0A)
ACT  A 501 (-3.7A)
None
ZN  A 500 (-2.2A)
None
 0.89A 1zz1C-4a69A:
44.1		 1zz1C-4a69A:
26.42
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.
1ZZ1_C_SHHC2652_1
(HISTONE
DEACETYLASE-LIKE
AMIDOHYDROLASE)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		9 / 12 HIS A 134
HIS A 135
GLY A 143
ASP A 170
HIS A 172
PHE A 200
ASP A 259
GLY A 296
TYR A 298
 ACT  A 501 (-4.0A)
ACT  A 501 (-3.7A)
None
ZN  A 500 (-2.2A)
ZN  A 500 (-3.1A)
None
ZN  A 500 ( 2.4A)
ACT  A 501 (-3.0A)
ACT  A 501 (-4.7A)
 0.53A 1zz1C-4a69A:
44.1		 1zz1C-4a69A:
26.42
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.
1ZZ1_C_SHHC2652_1
(HISTONE
DEACETYLASE-LIKE
AMIDOHYDROLASE)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		5 / 12 HIS A 134
HIS A 172
ASP A 259
GLY A 296
TYR A 298
 ACT  A 501 (-4.0A)
ZN  A 500 (-3.1A)
ZN  A 500 ( 2.4A)
ACT  A 501 (-3.0A)
ACT  A 501 (-4.7A)
 1.04A 1zz1C-4a69A:
44.1		 1zz1C-4a69A:
26.42
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.
1ZZ1_D_SHHD2752_1
(HISTONE
DEACETYLASE-LIKE
AMIDOHYDROLASE)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		8 / 9 HIS A 134
HIS A 135
PHE A 144
ASP A 170
HIS A 172
PHE A 200
ASP A 259
TYR A 298
 ACT  A 501 (-4.0A)
ACT  A 501 (-3.7A)
None
ZN  A 500 (-2.2A)
ZN  A 500 (-3.1A)
None
ZN  A 500 ( 2.4A)
ACT  A 501 (-4.7A)
 0.56A 1zz1D-4a69A:
43.9		 1zz1D-4a69A:
26.42
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.
2E5D_A_NCAA1501_0
(NICOTINAMIDE
PHOSPHORIBOSYLTRANSF
ERASE)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		4 / 7 ASP A 264
ARG A  28
ASP A 259
TYR A 298
 None
None
ZN  A 500 ( 2.4A)
ACT  A 501 (-4.7A)
 1.16A 2e5dA-4a69A:
undetectable
2e5dB-4a69A:
undetectable		 2e5dA-4a69A:
21.26
2e5dB-4a69A:
21.26
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.
2E5D_B_NCAB1502_0
(NICOTINAMIDE
PHOSPHORIBOSYLTRANSF
ERASE)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		4 / 7 ASP A 259
TYR A 298
ASP A 264
ARG A  28
 ZN  A 500 ( 2.4A)
ACT  A 501 (-4.7A)
None
None
 1.24A 2e5dA-4a69A:
undetectable
2e5dB-4a69A:
undetectable		 2e5dA-4a69A:
21.26
2e5dB-4a69A:
21.26
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.
2H42_C_VIAC903_2
(CGMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		3 / 3 ASN A 128
ILE A 125
MET A  45
 None
 0.79A 2h42C-4a69A:
undetectable		 2h42C-4a69A:
20.20
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.
2NV4_B_SAMB202_0
(UPF0066 PROTEIN
AF_0241)		 4a69 HISTONE DEACETYLASE
3,
NUCLEAR RECEPTOR
COREPRESSOR 2
(Homo
sapiens;
Homo
sapiens) 		5 / 12 GLN A  52
GLN A 117
PRO A  50
GLY C 414
LEU C 415
 None
 1.33A 2nv4B-4a69A:
undetectable		 2nv4B-4a69A:
17.82
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.
2OIP_A_MTXA605_1
(CHAIN A, CRYSTAL
STRUCTURE OF DHFR)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		5 / 12 LEU A 355
PHE A 192
SER A 191
ILE A 362
LEU A 219
 None
None
K  A 503 (-2.9A)
None
None
 1.15A 2oipA-4a69A:
undetectable		 2oipA-4a69A:
21.40
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.
2R5P_D_MK1D902_2
(PROTEASE)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		5 / 12 GLY A 267
ILE A 346
GLY A 226
ILE A 227
VAL A 342
 None
 0.88A 2r5pD-4a69A:
undetectable		 2r5pD-4a69A:
14.02
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.
2R5Q_B_1UNB900_2
(PROTEASE)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		5 / 11 GLY A 267
ILE A 346
GLY A 226
ILE A 227
VAL A 342
 None
 0.84A 2r5qB-4a69A:
undetectable		 2r5qB-4a69A:
14.02
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.
2W8Y_A_486A1000_1
(PROGESTERONE
RECEPTOR)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		5 / 12 LEU A 133
GLY A 132
ARG A  28
PHE A 200
VAL A 253
 None
 1.39A 2w8yA-4a69A:
undetectable		 2w8yA-4a69A:
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.
3C0Z_A_SHHA301_1
(HISTONE DEACETYLASE
7A)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		5 / 5 HIS A 134
HIS A 135
ASP A 170
HIS A 172
ASP A 259
 ACT  A 501 (-4.0A)
ACT  A 501 (-3.7A)
ZN  A 500 (-2.2A)
ZN  A 500 (-3.1A)
ZN  A 500 ( 2.4A)
 0.16A 3c0zA-4a69A:
41.3		 3c0zA-4a69A:
24.45
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_B_SHHB301_1
(HISTONE DEACETYLASE
7A)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		4 / 8 HIS A 134
ASP A 170
ASP A 259
GLY A 257
 ACT  A 501 (-4.0A)
ZN  A 500 (-2.2A)
ZN  A 500 ( 2.4A)
None
 0.85A 3c0zB-4a69A:
41.3		 3c0zB-4a69A:
24.45
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_B_SHHB301_1
(HISTONE DEACETYLASE
7A)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		4 / 8 HIS A 134
HIS A 135
ASP A 170
GLY A 295
 ACT  A 501 (-4.0A)
ACT  A 501 (-3.7A)
ZN  A 500 (-2.2A)
None
 0.80A 3c0zB-4a69A:
41.3		 3c0zB-4a69A:
24.45
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_B_SHHB301_1
(HISTONE DEACETYLASE
7A)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		8 / 8 HIS A 134
HIS A 135
PHE A 144
ASP A 170
HIS A 172
PHE A 200
ASP A 259
GLY A 296
 ACT  A 501 (-4.0A)
ACT  A 501 (-3.7A)
None
ZN  A 500 (-2.2A)
ZN  A 500 (-3.1A)
None
ZN  A 500 ( 2.4A)
ACT  A 501 (-3.0A)
 0.38A 3c0zB-4a69A:
41.3		 3c0zB-4a69A:
24.45
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_B_SHHB301_1
(HISTONE DEACETYLASE
7A)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		4 / 8 PHE A 200
ASP A 259
PHE A 144
ASP A 170
 None
ZN  A 500 ( 2.4A)
None
ZN  A 500 (-2.2A)
 0.89A 3c0zB-4a69A:
41.3		 3c0zB-4a69A:
24.45
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_C_SHHC301_1
(HISTONE DEACETYLASE
7A)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		6 / 6 ASP A  93
HIS A 134
HIS A 135
ASP A 170
HIS A 172
ASP A 259
 None
ACT  A 501 (-4.0A)
ACT  A 501 (-3.7A)
ZN  A 500 (-2.2A)
ZN  A 500 (-3.1A)
ZN  A 500 ( 2.4A)
 0.27A 3c0zC-4a69A:
41.4		 3c0zC-4a69A:
24.45
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.
3CR5_X_PNTX94_0
(PROTEIN S100-B)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		3 / 3 PHE A 199
CYH A 268
PHE A 269
 None
 0.92A 3cr5X-4a69A:
undetectable		 3cr5X-4a69A:
13.14
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.
3D41_A_FCNA4001_1
(FOMA PROTEIN)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		5 / 8 GLY A 257
GLY A 295
GLY A 132
HIS A 134
ILE A 150
 None
None
None
ACT  A 501 (-4.0A)
None
 1.01A 3d41A-4a69A:
2.3		 3d41A-4a69A:
21.45
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.
3D41_A_FCNA4001_1
(FOMA PROTEIN)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		5 / 8 GLY A 296
GLY A 295
GLY A 132
HIS A 134
ILE A 150
 ACT  A 501 (-3.0A)
None
None
ACT  A 501 (-4.0A)
None
 1.21A 3d41A-4a69A:
2.3		 3d41A-4a69A:
21.45
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.
3E23_A_SAMA221_1
(UNCHARACTERIZED
PROTEIN RPA2492)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		3 / 3 TYR A 166
ASP A 149
HIS A 135
 None
None
ACT  A 501 (-3.7A)
 0.82A 3e23A-4a69A:
3.3		 3e23A-4a69A:
21.01
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.
3NDX_A_RITA100_2
(PROTEASE)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		5 / 11 GLY A 267
ILE A 346
GLY A 226
ILE A 227
VAL A 342
 None
 0.88A 3ndxB-4a69A:
undetectable		 3ndxB-4a69A:
12.40
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.
3PGH_A_FLPA701_1
(CYCLOOXYGENASE-2)		 4a69 HISTONE DEACETYLASE
3,
NUCLEAR RECEPTOR
COREPRESSOR 2
(Homo
sapiens) 		5 / 12 VAL A 300
LEU C 472
ALA A  30
SER A  34
LEU A  31
 I0P  C 501 (-4.2A)
None
None
None
None
 1.18A 3pghA-4a69A:
undetectable		 3pghA-4a69A:
21.91
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.
3ZJQ_A_NCAA300_0
(PROTOGLOBIN)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		4 / 7 TYR A 247
VAL A 243
VAL A 187
ILE A 288
 None
 0.98A 3zjqA-4a69A:
undetectable		 3zjqA-4a69A:
20.71
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.
4BLV_A_SAMA1281_0
(RIBOSOMAL RNA LARGE
SUBUNIT
METHYLTRANSFERASE J)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		5 / 12 LEU A  29
ASP A 170
GLY A 297
GLY A 267
GLY A 132
 None
ZN  A 500 (-2.2A)
None
None
None
 1.16A 4blvA-4a69A:
5.6		 4blvA-4a69A:
21.36
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4BZ6_A_SHHA700_1
(HISTONE DEACETYLASE
8)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		5 / 10 HIS A 134
HIS A 135
ASP A 170
ASP A 259
GLY A 257
 ACT  A 501 (-4.0A)
ACT  A 501 (-3.7A)
ZN  A 500 (-2.2A)
ZN  A 500 ( 2.4A)
None
 1.42A 4bz6A-4a69A:
52.2		 4bz6A-4a69A:
34.59
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4BZ6_A_SHHA700_1
(HISTONE DEACETYLASE
8)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		7 / 10 HIS A 134
HIS A 135
ASP A 170
HIS A 172
ASP A 259
GLY A 296
TYR A 298
 ACT  A 501 (-4.0A)
ACT  A 501 (-3.7A)
ZN  A 500 (-2.2A)
ZN  A 500 (-3.1A)
ZN  A 500 ( 2.4A)
ACT  A 501 (-3.0A)
ACT  A 501 (-4.7A)
 0.26A 4bz6A-4a69A:
52.2		 4bz6A-4a69A:
34.59
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4BZ6_A_SHHA700_1
(HISTONE DEACETYLASE
8)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		5 / 10 HIS A 134
HIS A 172
ASP A 259
GLY A 296
TYR A 298
 ACT  A 501 (-4.0A)
ZN  A 500 (-3.1A)
ZN  A 500 ( 2.4A)
ACT  A 501 (-3.0A)
ACT  A 501 (-4.7A)
 0.95A 4bz6A-4a69A:
52.2		 4bz6A-4a69A:
34.59
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4BZ6_B_SHHB700_1
(HISTONE DEACETYLASE
8)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		5 / 12 HIS A 134
HIS A 135
ASP A 170
ASP A 259
GLY A 257
 ACT  A 501 (-4.0A)
ACT  A 501 (-3.7A)
ZN  A 500 (-2.2A)
ZN  A 500 ( 2.4A)
None
 1.42A 4bz6A-4a69A:
52.2
4bz6B-4a69A:
52.2		 4bz6A-4a69A:
34.59
4bz6B-4a69A:
34.59
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4BZ6_B_SHHB700_1
(HISTONE DEACETYLASE
8)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		8 / 12 HIS A 134
HIS A 135
ASP A 170
HIS A 172
PHE A 200
ASP A 259
GLY A 296
TYR A 298
 ACT  A 501 (-4.0A)
ACT  A 501 (-3.7A)
ZN  A 500 (-2.2A)
ZN  A 500 (-3.1A)
None
ZN  A 500 ( 2.4A)
ACT  A 501 (-3.0A)
ACT  A 501 (-4.7A)
 0.34A 4bz6A-4a69A:
52.2
4bz6B-4a69A:
52.2		 4bz6A-4a69A:
34.59
4bz6B-4a69A:
34.59
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4BZ6_B_SHHB700_1
(HISTONE DEACETYLASE
8)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		5 / 12 HIS A 134
HIS A 172
ASP A 259
GLY A 296
TYR A 298
 ACT  A 501 (-4.0A)
ZN  A 500 (-3.1A)
ZN  A 500 ( 2.4A)
ACT  A 501 (-3.0A)
ACT  A 501 (-4.7A)
 0.97A 4bz6A-4a69A:
52.2
4bz6B-4a69A:
52.2		 4bz6A-4a69A:
34.59
4bz6B-4a69A:
34.59
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4BZ6_C_SHHC700_1
(HISTONE DEACETYLASE
8)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		5 / 12 HIS A 134
HIS A 135
GLY A 143
ASP A 170
GLY A 295
 ACT  A 501 (-4.0A)
ACT  A 501 (-3.7A)
None
ZN  A 500 (-2.2A)
None
 0.88A 4bz6C-4a69A:
52.2		 4bz6C-4a69A:
34.59
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4BZ6_C_SHHC700_1
(HISTONE DEACETYLASE
8)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		9 / 12 HIS A 134
HIS A 135
GLY A 143
ASP A 170
HIS A 172
PHE A 200
ASP A 259
GLY A 296
TYR A 298
 ACT  A 501 (-4.0A)
ACT  A 501 (-3.7A)
None
ZN  A 500 (-2.2A)
ZN  A 500 (-3.1A)
None
ZN  A 500 ( 2.4A)
ACT  A 501 (-3.0A)
ACT  A 501 (-4.7A)
 0.34A 4bz6C-4a69A:
52.2		 4bz6C-4a69A:
34.59
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4BZ6_C_SHHC700_1
(HISTONE DEACETYLASE
8)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		5 / 12 HIS A 134
HIS A 172
ASP A 259
GLY A 296
TYR A 298
 ACT  A 501 (-4.0A)
ZN  A 500 (-3.1A)
ZN  A 500 ( 2.4A)
ACT  A 501 (-3.0A)
ACT  A 501 (-4.7A)
 0.95A 4bz6C-4a69A:
52.2		 4bz6C-4a69A:
34.59
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4BZ6_D_SHHD700_1
(HISTONE DEACETYLASE
8)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		5 / 10 HIS A 134
HIS A 135
ASP A 170
ASP A 259
GLY A 257
 ACT  A 501 (-4.0A)
ACT  A 501 (-3.7A)
ZN  A 500 (-2.2A)
ZN  A 500 ( 2.4A)
None
 1.41A 4bz6D-4a69A:
52.4		 4bz6D-4a69A:
34.59
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4BZ6_D_SHHD700_1
(HISTONE DEACETYLASE
8)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		7 / 10 HIS A 134
HIS A 135
ASP A 170
HIS A 172
ASP A 259
GLY A 296
TYR A 298
 ACT  A 501 (-4.0A)
ACT  A 501 (-3.7A)
ZN  A 500 (-2.2A)
ZN  A 500 (-3.1A)
ZN  A 500 ( 2.4A)
ACT  A 501 (-3.0A)
ACT  A 501 (-4.7A)
 0.25A 4bz6D-4a69A:
52.4		 4bz6D-4a69A:
34.59
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4BZ6_D_SHHD700_1
(HISTONE DEACETYLASE
8)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		5 / 10 HIS A 134
HIS A 172
ASP A 259
GLY A 296
TYR A 298
 ACT  A 501 (-4.0A)
ZN  A 500 (-3.1A)
ZN  A 500 ( 2.4A)
ACT  A 501 (-3.0A)
ACT  A 501 (-4.7A)
 0.96A 4bz6D-4a69A:
52.4		 4bz6D-4a69A:
34.59
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.
4K0B_B_SAMB504_1
(S-ADENOSYLMETHIONINE
SYNTHASE)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		4 / 8 HIS A  56
ASP A  57
TYR A  51
SER A  54
 None
None
GOL  A 505 ( 3.8A)
None
 1.06A 4k0bB-4a69A:
undetectable		 4k0bB-4a69A:
20.56
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.
4L7I_B_SAMB501_1
(S-ADENOSYLMETHIONINE
SYNTHASE)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		4 / 8 HIS A  56
ASP A  57
TYR A  51
SER A  54
 None
None
GOL  A 505 ( 3.8A)
None
 1.05A 4l7iB-4a69A:
undetectable		 4l7iB-4a69A:
20.56
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4LXZ_A_SHHA407_1
(HISTONE DEACETYLASE
2)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		6 / 12 ASP A  93
HIS A 134
HIS A 135
GLY A 143
ASP A 170
GLY A 295
 None
ACT  A 501 (-4.0A)
ACT  A 501 (-3.7A)
None
ZN  A 500 (-2.2A)
None
 0.93A 4lxzA-4a69A:
63.6		 4lxzA-4a69A:
62.80
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4LXZ_A_SHHA407_1
(HISTONE DEACETYLASE
2)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		5 / 12 HIS A  22
ASP A  93
HIS A 172
PHE A 144
GLY A 297
 None
None
ZN  A 500 (-3.1A)
None
None
 1.15A 4lxzA-4a69A:
63.6		 4lxzA-4a69A:
62.80
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4LXZ_A_SHHA407_1
(HISTONE DEACETYLASE
2)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		6 / 12 HIS A  22
ASP A  93
PHE A 144
ASP A 259
GLY A 297
TYR A 298
 None
None
None
ZN  A 500 ( 2.4A)
None
ACT  A 501 (-4.7A)
 1.22A 4lxzA-4a69A:
63.6		 4lxzA-4a69A:
62.80
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4LXZ_A_SHHA407_1
(HISTONE DEACETYLASE
2)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		12 / 12 HIS A  22
PRO A  23
ASP A  93
HIS A 134
HIS A 135
GLY A 143
PHE A 144
ASP A 170
HIS A 172
ASP A 259
GLY A 296
TYR A 298
 None
None
None
ACT  A 501 (-4.0A)
ACT  A 501 (-3.7A)
None
None
ZN  A 500 (-2.2A)
ZN  A 500 (-3.1A)
ZN  A 500 ( 2.4A)
ACT  A 501 (-3.0A)
ACT  A 501 (-4.7A)
 0.30A 4lxzA-4a69A:
63.6		 4lxzA-4a69A:
62.80
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4LXZ_A_SHHA407_1
(HISTONE DEACETYLASE
2)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		5 / 12 HIS A 134
HIS A 172
ASP A 259
GLY A 296
TYR A 298
 ACT  A 501 (-4.0A)
ZN  A 500 (-3.1A)
ZN  A 500 ( 2.4A)
ACT  A 501 (-3.0A)
ACT  A 501 (-4.7A)
 0.93A 4lxzA-4a69A:
63.6		 4lxzA-4a69A:
62.80
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4LXZ_A_SHHA407_1
(HISTONE DEACETYLASE
2)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		5 / 12 PRO A  23
HIS A 135
HIS A 172
ASP A 259
TYR A 298
 None
ACT  A 501 (-3.7A)
ZN  A 500 (-3.1A)
ZN  A 500 ( 2.4A)
ACT  A 501 (-4.7A)
 1.09A 4lxzA-4a69A:
63.6		 4lxzA-4a69A:
62.80
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4LXZ_B_SHHB408_1
(HISTONE DEACETYLASE
2)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		5 / 11 ASP A  93
HIS A 134
HIS A 135
ASP A 170
GLY A 295
 None
ACT  A 501 (-4.0A)
ACT  A 501 (-3.7A)
ZN  A 500 (-2.2A)
None
 1.00A 4lxzB-4a69A:
63.6		 4lxzB-4a69A:
62.80
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4LXZ_B_SHHB408_1
(HISTONE DEACETYLASE
2)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		5 / 11 ASP A  93
HIS A 172
PHE A 144
ASP A 264
GLY A 297
 None
ZN  A 500 (-3.1A)
None
None
None
 1.22A 4lxzB-4a69A:
63.6		 4lxzB-4a69A:
62.80
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4LXZ_B_SHHB408_1
(HISTONE DEACETYLASE
2)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		5 / 11 HIS A  22
ASP A  93
HIS A 172
PHE A 144
GLY A 297
 None
None
ZN  A 500 (-3.1A)
None
None
 1.15A 4lxzB-4a69A:
63.6		 4lxzB-4a69A:
62.80
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4LXZ_B_SHHB408_1
(HISTONE DEACETYLASE
2)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		11 / 11 HIS A  22
PRO A  23
ASP A  93
HIS A 134
HIS A 135
PHE A 144
ASP A 170
HIS A 172
ASP A 259
GLY A 296
TYR A 298
 None
None
None
ACT  A 501 (-4.0A)
ACT  A 501 (-3.7A)
None
ZN  A 500 (-2.2A)
ZN  A 500 (-3.1A)
ZN  A 500 ( 2.4A)
ACT  A 501 (-3.0A)
ACT  A 501 (-4.7A)
 0.35A 4lxzB-4a69A:
63.6		 4lxzB-4a69A:
62.80
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4LXZ_B_SHHB408_1
(HISTONE DEACETYLASE
2)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		7 / 11 HIS A  22
PRO A  23
ASP A  93
PHE A 144
ASP A 259
GLY A 297
TYR A 298
 None
None
None
None
ZN  A 500 ( 2.4A)
None
ACT  A 501 (-4.7A)
 1.14A 4lxzB-4a69A:
63.6		 4lxzB-4a69A:
62.80
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4LXZ_B_SHHB408_1
(HISTONE DEACETYLASE
2)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		5 / 11 HIS A 134
HIS A 172
ASP A 259
GLY A 296
TYR A 298
 ACT  A 501 (-4.0A)
ZN  A 500 (-3.1A)
ZN  A 500 ( 2.4A)
ACT  A 501 (-3.0A)
ACT  A 501 (-4.7A)
 0.96A 4lxzB-4a69A:
63.6		 4lxzB-4a69A:
62.80
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4LXZ_B_SHHB408_1
(HISTONE DEACETYLASE
2)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		5 / 11 PRO A  23
HIS A 135
HIS A 172
ASP A 259
TYR A 298
 None
ACT  A 501 (-3.7A)
ZN  A 500 (-3.1A)
ZN  A 500 ( 2.4A)
ACT  A 501 (-4.7A)
 1.07A 4lxzB-4a69A:
63.6		 4lxzB-4a69A:
62.80
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4LXZ_C_SHHC406_1
(HISTONE DEACETYLASE
2)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		6 / 12 ASP A  93
HIS A 134
HIS A 135
GLY A 143
ASP A 170
GLY A 295
 None
ACT  A 501 (-4.0A)
ACT  A 501 (-3.7A)
None
ZN  A 500 (-2.2A)
None
 0.93A 4lxzC-4a69A:
64.1		 4lxzC-4a69A:
62.80
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4LXZ_C_SHHC406_1
(HISTONE DEACETYLASE
2)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		5 / 12 ASP A  93
HIS A 172
PHE A 144
ASP A 264
GLY A 297
 None
ZN  A 500 (-3.1A)
None
None
None
 1.22A 4lxzC-4a69A:
64.1		 4lxzC-4a69A:
62.80
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4LXZ_C_SHHC406_1
(HISTONE DEACETYLASE
2)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		5 / 12 HIS A 134
HIS A 172
ASP A 259
GLY A 296
TYR A 298
 ACT  A 501 (-4.0A)
ZN  A 500 (-3.1A)
ZN  A 500 ( 2.4A)
ACT  A 501 (-3.0A)
ACT  A 501 (-4.7A)
 0.95A 4lxzC-4a69A:
64.1		 4lxzC-4a69A:
62.80
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4LXZ_C_SHHC406_1
(HISTONE DEACETYLASE
2)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		12 / 12 PRO A  23
ASP A  93
HIS A 134
HIS A 135
GLY A 143
PHE A 144
ASP A 170
HIS A 172
PHE A 200
ASP A 259
GLY A 296
TYR A 298
 None
None
ACT  A 501 (-4.0A)
ACT  A 501 (-3.7A)
None
None
ZN  A 500 (-2.2A)
ZN  A 500 (-3.1A)
None
ZN  A 500 ( 2.4A)
ACT  A 501 (-3.0A)
ACT  A 501 (-4.7A)
 0.33A 4lxzC-4a69A:
64.1		 4lxzC-4a69A:
62.80
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4LXZ_C_SHHC406_1
(HISTONE DEACETYLASE
2)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		6 / 12 PRO A  23
ASP A  93
PHE A 144
ASP A 259
GLY A 297
TYR A 298
 None
None
None
ZN  A 500 ( 2.4A)
None
ACT  A 501 (-4.7A)
 1.21A 4lxzC-4a69A:
64.1		 4lxzC-4a69A:
62.80
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4LXZ_C_SHHC406_1
(HISTONE DEACETYLASE
2)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		5 / 12 PRO A  23
HIS A 135
HIS A 172
ASP A 259
TYR A 298
 None
ACT  A 501 (-3.7A)
ZN  A 500 (-3.1A)
ZN  A 500 ( 2.4A)
ACT  A 501 (-4.7A)
 1.07A 4lxzC-4a69A:
64.1		 4lxzC-4a69A:
62.80
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4QA0_A_SHHA404_1
(HISTONE DEACETYLASE
8)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		6 / 12 HIS A 134
HIS A 135
GLY A 143
PHE A 144
ASP A 170
GLY A 295
 ACT  A 501 (-4.0A)
ACT  A 501 (-3.7A)
None
None
ZN  A 500 (-2.2A)
None
 1.02A 4qa0A-4a69A:
56.0		 4qa0A-4a69A:
39.85
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4QA0_A_SHHA404_1
(HISTONE DEACETYLASE
8)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		10 / 12 HIS A 134
HIS A 135
GLY A 143
PHE A 144
ASP A 170
HIS A 172
PHE A 200
ASP A 259
GLY A 296
TYR A 298
 ACT  A 501 (-4.0A)
ACT  A 501 (-3.7A)
None
None
ZN  A 500 (-2.2A)
ZN  A 500 (-3.1A)
None
ZN  A 500 ( 2.4A)
ACT  A 501 (-3.0A)
ACT  A 501 (-4.7A)
 0.30A 4qa0A-4a69A:
56.0		 4qa0A-4a69A:
39.85
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4QA0_B_SHHB404_2
(HISTONE DEACETYLASE
8)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		5 / 11 HIS A 134
HIS A 135
ASP A 170
ASP A 259
GLY A 257
 ACT  A 501 (-4.0A)
ACT  A 501 (-3.7A)
ZN  A 500 (-2.2A)
ZN  A 500 ( 2.4A)
None
 1.40A 4qa0B-4a69A:
56.1		 4qa0B-4a69A:
39.85
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4QA0_B_SHHB404_2
(HISTONE DEACETYLASE
8)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		5 / 11 HIS A 134
HIS A 135
PHE A 144
ASP A 170
GLY A 295
 ACT  A 501 (-4.0A)
ACT  A 501 (-3.7A)
None
ZN  A 500 (-2.2A)
None
 1.10A 4qa0B-4a69A:
56.1		 4qa0B-4a69A:
39.85
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4QA0_B_SHHB404_2
(HISTONE DEACETYLASE
8)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		9 / 11 HIS A 134
HIS A 135
PHE A 144
ASP A 170
HIS A 172
PHE A 200
ASP A 259
GLY A 296
TYR A 298
 ACT  A 501 (-4.0A)
ACT  A 501 (-3.7A)
None
ZN  A 500 (-2.2A)
ZN  A 500 (-3.1A)
None
ZN  A 500 ( 2.4A)
ACT  A 501 (-3.0A)
ACT  A 501 (-4.7A)
 0.27A 4qa0B-4a69A:
56.1		 4qa0B-4a69A:
39.85
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4QA0_B_SHHB404_2
(HISTONE DEACETYLASE
8)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		5 / 11 HIS A 135
HIS A 172
ASP A 259
GLY A 296
TYR A 298
 ACT  A 501 (-3.7A)
ZN  A 500 (-3.1A)
ZN  A 500 ( 2.4A)
ACT  A 501 (-3.0A)
ACT  A 501 (-4.7A)
 1.07A 4qa0B-4a69A:
56.1		 4qa0B-4a69A:
39.85
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4QA0_B_SHHB404_2
(HISTONE DEACETYLASE
8)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		5 / 11 TYR A 146
HIS A 134
HIS A 172
ASP A 259
TYR A 298
 None
ACT  A 501 (-4.0A)
ZN  A 500 (-3.1A)
ZN  A 500 ( 2.4A)
ACT  A 501 (-4.7A)
 1.34A 4qa0B-4a69A:
56.1		 4qa0B-4a69A:
39.85
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4QA2_A_SHHA404_1
(HISTONE DEACETYLASE
8)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		6 / 12 HIS A 134
HIS A 135
GLY A 143
PHE A 144
ASP A 170
GLY A 295
 ACT  A 501 (-4.0A)
ACT  A 501 (-3.7A)
None
None
ZN  A 500 (-2.2A)
None
 1.07A 4qa2A-4a69A:
55.0		 4qa2A-4a69A:
40.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4QA2_A_SHHA404_1
(HISTONE DEACETYLASE
8)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		10 / 12 HIS A 134
HIS A 135
GLY A 143
PHE A 144
ASP A 170
HIS A 172
PHE A 200
ASP A 259
GLY A 296
TYR A 298
 ACT  A 501 (-4.0A)
ACT  A 501 (-3.7A)
None
None
ZN  A 500 (-2.2A)
ZN  A 500 (-3.1A)
None
ZN  A 500 ( 2.4A)
ACT  A 501 (-3.0A)
ACT  A 501 (-4.7A)
 0.32A 4qa2A-4a69A:
55.0		 4qa2A-4a69A:
40.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4QA2_A_SHHA404_1
(HISTONE DEACETYLASE
8)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		5 / 12 HIS A 135
HIS A 172
ASP A 259
GLY A 296
TYR A 298
 ACT  A 501 (-3.7A)
ZN  A 500 (-3.1A)
ZN  A 500 ( 2.4A)
ACT  A 501 (-3.0A)
ACT  A 501 (-4.7A)
 1.08A 4qa2A-4a69A:
55.0		 4qa2A-4a69A:
40.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4QA2_B_SHHB404_1
(HISTONE DEACETYLASE
8)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		6 / 12 HIS A 134
HIS A 135
ASP A 170
HIS A 172
ASP A 259
GLY A 257
 ACT  A 501 (-4.0A)
ACT  A 501 (-3.7A)
ZN  A 500 (-2.2A)
ZN  A 500 (-3.1A)
ZN  A 500 ( 2.4A)
None
 1.33A 4qa2B-4a69A:
56.3		 4qa2B-4a69A:
40.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4QA2_B_SHHB404_1
(HISTONE DEACETYLASE
8)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		6 / 12 HIS A 134
HIS A 135
GLY A 143
PHE A 144
ASP A 170
GLY A 295
 ACT  A 501 (-4.0A)
ACT  A 501 (-3.7A)
None
None
ZN  A 500 (-2.2A)
None
 1.08A 4qa2B-4a69A:
56.3		 4qa2B-4a69A:
40.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4QA2_B_SHHB404_1
(HISTONE DEACETYLASE
8)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		10 / 12 HIS A 134
HIS A 135
GLY A 143
PHE A 144
ASP A 170
HIS A 172
PHE A 200
ASP A 259
GLY A 296
TYR A 298
 ACT  A 501 (-4.0A)
ACT  A 501 (-3.7A)
None
None
ZN  A 500 (-2.2A)
ZN  A 500 (-3.1A)
None
ZN  A 500 ( 2.4A)
ACT  A 501 (-3.0A)
ACT  A 501 (-4.7A)
 0.30A 4qa2B-4a69A:
56.3		 4qa2B-4a69A:
40.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4QA2_B_SHHB404_1
(HISTONE DEACETYLASE
8)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		5 / 12 HIS A 135
HIS A 172
ASP A 259
GLY A 296
TYR A 298
 ACT  A 501 (-3.7A)
ZN  A 500 (-3.1A)
ZN  A 500 ( 2.4A)
ACT  A 501 (-3.0A)
ACT  A 501 (-4.7A)
 1.08A 4qa2B-4a69A:
56.3		 4qa2B-4a69A:
40.10
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.
4V20_A_ACTA1444_0
(CELLOBIOHYDROLASE)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		4 / 5 GLY A 204
THR A 203
GLY A 174
GLU A 208
 None
 0.97A 4v20A-4a69A:
undetectable		 4v20A-4a69A:
19.25
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)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		11 / 12 PRO A  23
HIS A 134
HIS A 135
GLY A 143
PHE A 144
ASP A 170
HIS A 172
PHE A 200
ASP A 259
LEU A 266
TYR A 298
 None
ACT  A 501 (-4.0A)
ACT  A 501 (-3.7A)
None
None
ZN  A 500 (-2.2A)
ZN  A 500 (-3.1A)
None
ZN  A 500 ( 2.4A)
None
ACT  A 501 (-4.7A)
 0.44A 5eeiA-4a69A:
42.8		 5eeiA-4a69A:
26.04
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)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		6 / 12 PRO A  23
HIS A 135
HIS A 172
ASP A 259
LEU A 266
TYR A 298
 None
ACT  A 501 (-3.7A)
ZN  A 500 (-3.1A)
ZN  A 500 ( 2.4A)
None
ACT  A 501 (-4.7A)
 1.09A 5eeiA-4a69A:
42.8		 5eeiA-4a69A:
26.04
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)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		5 / 12 SER A 142
HIS A 134
HIS A 172
ASP A 259
TYR A 298
 None
ACT  A 501 (-4.0A)
ZN  A 500 (-3.1A)
ZN  A 500 ( 2.4A)
ACT  A 501 (-4.7A)
 1.06A 5eeiA-4a69A:
42.8		 5eeiA-4a69A:
26.04
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)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		11 / 12 PRO A  23
HIS A 134
HIS A 135
GLY A 143
PHE A 144
ASP A 170
HIS A 172
PHE A 200
ASP A 259
LEU A 266
TYR A 298
 None
ACT  A 501 (-4.0A)
ACT  A 501 (-3.7A)
None
None
ZN  A 500 (-2.2A)
ZN  A 500 (-3.1A)
None
ZN  A 500 ( 2.4A)
None
ACT  A 501 (-4.7A)
 0.43A 5eeiB-4a69A:
42.9		 5eeiB-4a69A:
26.04
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)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		6 / 12 PRO A  23
HIS A 135
HIS A 172
ASP A 259
LEU A 266
TYR A 298
 None
ACT  A 501 (-3.7A)
ZN  A 500 (-3.1A)
ZN  A 500 ( 2.4A)
None
ACT  A 501 (-4.7A)
 1.09A 5eeiB-4a69A:
42.9		 5eeiB-4a69A:
26.04
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)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		5 / 12 SER A 142
HIS A 134
HIS A 172
ASP A 259
TYR A 298
 None
ACT  A 501 (-4.0A)
ZN  A 500 (-3.1A)
ZN  A 500 ( 2.4A)
ACT  A 501 (-4.7A)
 1.05A 5eeiB-4a69A:
42.9		 5eeiB-4a69A:
26.04
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_A_5OGA804_1
(HDAC6 PROTEIN)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		6 / 12 HIS A  22
PHE A 144
HIS A 172
ASP A 259
GLY A 297
TYR A 298
 None
None
ZN  A 500 (-3.1A)
ZN  A 500 ( 2.4A)
None
ACT  A 501 (-4.7A)
 1.30A 5eenA-4a69A:
43.0		 5eenA-4a69A:
26.04
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_A_5OGA804_1
(HDAC6 PROTEIN)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		11 / 12 HIS A  22
PRO A  23
HIS A 134
HIS A 135
PHE A 144
ASP A 170
HIS A 172
PHE A 200
ASP A 259
GLY A 296
TYR A 298
 None
None
ACT  A 501 (-4.0A)
ACT  A 501 (-3.7A)
None
ZN  A 500 (-2.2A)
ZN  A 500 (-3.1A)
None
ZN  A 500 ( 2.4A)
ACT  A 501 (-3.0A)
ACT  A 501 (-4.7A)
 0.52A 5eenA-4a69A:
43.0		 5eenA-4a69A:
26.04
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_A_5OGA804_1
(HDAC6 PROTEIN)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		5 / 12 HIS A 134
ASP A 170
HIS A 172
ASP A 259
GLY A 257
 ACT  A 501 (-4.0A)
ZN  A 500 (-2.2A)
ZN  A 500 (-3.1A)
ZN  A 500 ( 2.4A)
None
 1.25A 5eenA-4a69A:
43.0		 5eenA-4a69A:
26.04
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_A_5OGA804_1
(HDAC6 PROTEIN)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		6 / 12 SER A 142
HIS A 134
HIS A 172
ASP A 259
GLY A 296
TYR A 298
 None
ACT  A 501 (-4.0A)
ZN  A 500 (-3.1A)
ZN  A 500 ( 2.4A)
ACT  A 501 (-3.0A)
ACT  A 501 (-4.7A)
 1.01A 5eenA-4a69A:
43.0		 5eenA-4a69A:
26.04
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_A_5OGA804_1
(HDAC6 PROTEIN)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		6 / 12 SER A 142
HIS A 172
PHE A 200
ASP A 259
GLY A 296
TYR A 298
 None
ZN  A 500 (-3.1A)
None
ZN  A 500 ( 2.4A)
ACT  A 501 (-3.0A)
ACT  A 501 (-4.7A)
 1.37A 5eenA-4a69A:
43.0		 5eenA-4a69A:
26.04
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)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		11 / 12 HIS A  22
PRO A  23
HIS A 134
HIS A 135
PHE A 144
ASP A 170
HIS A 172
PHE A 200
ASP A 259
LEU A 266
TYR A 298
 None
None
ACT  A 501 (-4.0A)
ACT  A 501 (-3.7A)
None
ZN  A 500 (-2.2A)
ZN  A 500 (-3.1A)
None
ZN  A 500 ( 2.4A)
None
ACT  A 501 (-4.7A)
 0.52A 5eenB-4a69A:
43.1		 5eenB-4a69A:
26.04
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)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		6 / 12 PRO A  23
HIS A 135
HIS A 172
ASP A 259
LEU A 266
TYR A 298
 None
ACT  A 501 (-3.7A)
ZN  A 500 (-3.1A)
ZN  A 500 ( 2.4A)
None
ACT  A 501 (-4.7A)
 1.18A 5eenB-4a69A:
43.1		 5eenB-4a69A:
26.04
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)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		5 / 12 SER A 142
HIS A 134
HIS A 172
ASP A 259
TYR A 298
 None
ACT  A 501 (-4.0A)
ZN  A 500 (-3.1A)
ZN  A 500 ( 2.4A)
ACT  A 501 (-4.7A)
 1.02A 5eenB-4a69A:
43.1		 5eenB-4a69A:
26.04
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)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		5 / 12 SER A 142
HIS A 172
PHE A 200
ASP A 259
TYR A 298
 None
ZN  A 500 (-3.1A)
None
ZN  A 500 ( 2.4A)
ACT  A 501 (-4.7A)
 1.42A 5eenB-4a69A:
43.1		 5eenB-4a69A:
26.04
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)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		10 / 12 HIS A  22
PRO A  23
HIS A 134
HIS A 135
PHE A 144
ASP A 170
HIS A 172
PHE A 200
ASP A 259
TYR A 298
 None
None
ACT  A 501 (-4.0A)
ACT  A 501 (-3.7A)
None
ZN  A 500 (-2.2A)
ZN  A 500 (-3.1A)
None
ZN  A 500 ( 2.4A)
ACT  A 501 (-4.7A)
 0.55A 5ef8A-4a69A:
43.0		 5ef8A-4a69A:
26.04
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)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		5 / 12 PRO A  23
HIS A 135
HIS A 172
ASP A 259
TYR A 298
 None
ACT  A 501 (-3.7A)
ZN  A 500 (-3.1A)
ZN  A 500 ( 2.4A)
ACT  A 501 (-4.7A)
 1.09A 5ef8A-4a69A:
43.0		 5ef8A-4a69A:
26.04
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)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		5 / 12 SER A 142
HIS A 134
HIS A 172
ASP A 259
TYR A 298
 None
ACT  A 501 (-4.0A)
ZN  A 500 (-3.1A)
ZN  A 500 ( 2.4A)
ACT  A 501 (-4.7A)
 1.05A 5ef8A-4a69A:
43.0		 5ef8A-4a69A:
26.04
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)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		5 / 12 SER A 142
HIS A 172
PHE A 200
ASP A 259
TYR A 298
 None
ZN  A 500 (-3.1A)
None
ZN  A 500 ( 2.4A)
ACT  A 501 (-4.7A)
 1.33A 5ef8A-4a69A:
43.0		 5ef8A-4a69A:
26.04
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)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		10 / 12 PRO A  23
HIS A 134
HIS A 135
PHE A 144
ASP A 170
HIS A 172
PHE A 200
ASP A 259
LEU A 266
TYR A 298
 None
ACT  A 501 (-4.0A)
ACT  A 501 (-3.7A)
None
ZN  A 500 (-2.2A)
ZN  A 500 (-3.1A)
None
ZN  A 500 ( 2.4A)
None
ACT  A 501 (-4.7A)
 0.48A 5ef8B-4a69A:
43.1		 5ef8B-4a69A:
26.04
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)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		6 / 12 PRO A  23
HIS A 135
HIS A 172
ASP A 259
LEU A 266
TYR A 298
 None
ACT  A 501 (-3.7A)
ZN  A 500 (-3.1A)
ZN  A 500 ( 2.4A)
None
ACT  A 501 (-4.7A)
 1.18A 5ef8B-4a69A:
43.1		 5ef8B-4a69A:
26.04
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)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		5 / 12 SER A 142
HIS A 134
HIS A 172
ASP A 259
TYR A 298
 None
ACT  A 501 (-4.0A)
ZN  A 500 (-3.1A)
ZN  A 500 ( 2.4A)
ACT  A 501 (-4.7A)
 1.04A 5ef8B-4a69A:
43.1		 5ef8B-4a69A:
26.04
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)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		5 / 12 SER A 142
HIS A 172
PHE A 200
ASP A 259
TYR A 298
 None
ZN  A 500 (-3.1A)
None
ZN  A 500 ( 2.4A)
ACT  A 501 (-4.7A)
 1.41A 5ef8B-4a69A:
43.1		 5ef8B-4a69A:
26.04
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.
5N1T_W_CUW201_0
(COPC)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		3 / 3 HIS A 134
ASP A 175
HIS A 135
 ACT  A 501 (-4.0A)
None
ACT  A 501 (-3.7A)
 0.96A 5n1tW-4a69A:
undetectable		 5n1tW-4a69A:
17.29
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.
5O96_D_SAMD501_0
(RIBOSOMAL RNA SMALL
SUBUNIT
METHYLTRANSFERASE E)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		5 / 10 HIS A 172
ILE A 169
GLY A 257
GLY A 296
LEU A 271
 ZN  A 500 (-3.1A)
None
None
ACT  A 501 (-3.0A)
None
 1.00A 5o96C-4a69A:
undetectable
5o96D-4a69A:
undetectable		 5o96C-4a69A:
21.48
5o96D-4a69A:
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.
5VKQ_A_PCFA1803_0
(NO MECHANORECEPTOR
POTENTIAL C ISOFORM
L)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		5 / 10 ILE A 362
ILE A 358
LEU A 355
ILE A 240
ASN A 241
 None
 0.81A 5vkqA-4a69A:
undetectable
5vkqD-4a69A:
undetectable		 5vkqA-4a69A:
12.64
5vkqD-4a69A:
12.64
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.
5VKQ_B_PCFB1808_0
(NO MECHANORECEPTOR
POTENTIAL C ISOFORM
L)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		5 / 10 ILE A 240
ASN A 241
ILE A 362
ILE A 358
LEU A 355
 None
 0.79A 5vkqA-4a69A:
undetectable
5vkqB-4a69A:
undetectable		 5vkqA-4a69A:
12.64
5vkqB-4a69A:
12.64
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.
5VKQ_C_PCFC1801_0
(NO MECHANORECEPTOR
POTENTIAL C ISOFORM
L)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		4 / 9 ILE A 240
ILE A 362
ILE A 358
LEU A 355
 None
 0.74A 5vkqB-4a69A:
undetectable
5vkqC-4a69A:
undetectable		 5vkqB-4a69A:
12.64
5vkqC-4a69A:
12.64
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.
5VKQ_D_PCFD1801_0
(NO MECHANORECEPTOR
POTENTIAL C ISOFORM
L)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		5 / 10 ILE A 240
ASN A 241
ILE A 362
ILE A 358
LEU A 355
 None
 0.79A 5vkqC-4a69A:
undetectable
5vkqD-4a69A:
undetectable		 5vkqC-4a69A:
12.64
5vkqD-4a69A:
12.64
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.
5ZHM_B_SAMB301_1
(TRNA
(GUANINE-N(1)-)-METH
YLTRANSFERASE)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		6 / 12 GLY A 257
ILE A 150
VAL A 292
LEU A 293
GLY A 294
GLY A 295
 None
 1.20A 5zhmB-4a69A:
undetectable		 5zhmB-4a69A:
21.21
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.
5ZHM_B_SAMB301_1
(TRNA
(GUANINE-N(1)-)-METH
YLTRANSFERASE)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		6 / 12 GLY A 296
ILE A 150
VAL A 292
LEU A 293
GLY A 294
GLY A 295
 ACT  A 501 (-3.0A)
None
None
None
None
None
 1.36A 5zhmB-4a69A:
undetectable		 5zhmB-4a69A:
21.21
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.
6NJ9_K_SAMK500_0
(HISTONE-LYSINE
N-METHYLTRANSFERASE,
H3 LYSINE-79
SPECIFIC)		 4a69 HISTONE DEACETYLASE
3,
(Homo
sapiens) 		5 / 12 PRO A  26
GLY A 296
GLY A 131
GLY A 294
ASP A  10
 None
ACT  A 501 (-3.0A)
None
None
None
 0.98A 6nj9K-4a69A:
3.0		 6nj9K-4a69A:
19.91