SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4bkx'

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
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))		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		5 / 11 HIS B 141
HIS B 178
ASP B 264
LEU B 271
TYR B 303
 ACT  B 601 (-3.8A)
ZN  B 600 (-3.3A)
ZN  B 600 ( 2.5A)
None
ACT  B 601 ( 4.7A)
 0.90A 1c3sA-4bkxB:
47.3		 1c3sA-4bkxB:
32.93
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))		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		10 / 11 PRO B  29
HIS B 140
HIS B 141
PHE B 150
ASP B 176
HIS B 178
PHE B 205
ASP B 264
LEU B 271
TYR B 303
 None
ACT  B 601 (-3.7A)
ACT  B 601 (-3.8A)
None
ZN  B 600 (-2.2A)
ZN  B 600 (-3.3A)
None
ZN  B 600 ( 2.5A)
None
ACT  B 601 ( 4.7A)
 0.48A 1c3sA-4bkxB:
47.3		 1c3sA-4bkxB:
32.93
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))		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		5 / 11 PRO B  29
HIS B 140
HIS B 178
ASP B 264
TYR B 303
 None
ACT  B 601 (-3.7A)
ZN  B 600 (-3.3A)
ZN  B 600 ( 2.5A)
ACT  B 601 ( 4.7A)
 1.27A 1c3sA-4bkxB:
47.3		 1c3sA-4bkxB:
32.93
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)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		4 / 6 ASP B 176
GLY B 180
GLN B 260
TYR B 172
 ZN  B 600 (-2.2A)
None
None
None
 1.28A 1ekjC-4bkxB:
1.7
1ekjD-4bkxB:
undetectable		 1ekjC-4bkxB:
19.45
1ekjD-4bkxB:
19.45
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.
1EKJ_E_ACTE3005_0
(BETA-CARBONIC
ANHYDRASE)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		4 / 7 ASP B 176
HIS B 140
GLY B 300
GLY B 299
 ZN  B 600 (-2.2A)
ACT  B 601 (-3.7A)
ACT  B 601 ( 4.8A)
None
 0.98A 1ekjE-4bkxB:
undetectable
1ekjF-4bkxB:
undetectable		 1ekjE-4bkxB:
19.45
1ekjF-4bkxB:
19.45
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.
1HK3_A_T44A3004_1
(SERUM ALBUMIN)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		4 / 7 LEU B 171
VAL B 248
MET B 249
LEU B 373
 None
 0.98A 1hk3A-4bkxB:
undetectable		 1hk3A-4bkxB:
22.17
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.
1MXD_A_ACRA732_1
(ALPHA AMYLASE)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		5 / 9 GLY B 149
PRO B  29
GLY B 301
GLY B 302
ASP B 264
 None
None
ACT  B 601 (-3.4A)
None
ZN  B 600 ( 2.5A)
 1.14A 1mxdA-4bkxB:
undetectable		 1mxdA-4bkxB:
21.61
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)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		4 / 7 TYR B  13
TRP B 135
HIS B 281
GLY B 302
 None
 1.10A 1mxgA-4bkxB:
undetectable		 1mxgA-4bkxB:
21.61
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.
1QKN_A_RALA600_2
(ESTROGEN RECEPTOR
BETA)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		3 / 3 ASP B 269
LEU B 271
HIS B  33
 None
 0.79A 1qknA-4bkxB:
undetectable		 1qknA-4bkxB:
17.81
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)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		6 / 12 ASP B  99
GLY B 149
PHE B 150
ASP B 264
HIS B 178
PHE B 205
 None
None
None
ZN  B 600 ( 2.5A)
ZN  B 600 (-3.3A)
None
 1.24A 1t69A-4bkxB:
54.9		 1t69A-4bkxB:
33.61
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)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		10 / 12 ASP B  99
HIS B 140
HIS B 141
GLY B 149
PHE B 150
ASP B 176
HIS B 178
PHE B 205
ASP B 264
TYR B 303
 None
ACT  B 601 (-3.7A)
ACT  B 601 (-3.8A)
None
None
ZN  B 600 (-2.2A)
ZN  B 600 (-3.3A)
None
ZN  B 600 ( 2.5A)
ACT  B 601 ( 4.7A)
 0.61A 1t69A-4bkxB:
54.9		 1t69A-4bkxB:
33.61
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.
1TW4_A_CHDA131_0
(FATTY ACID-BINDING
PROTEIN)		 4bkx METASTASIS-ASSOCIATE
D PROTEIN MTA1
HISTONE DEACETYLASE
1
(Homo
sapiens;
Homo
sapiens) 		5 / 11 ASN B 225
THR B 208
LYS A 165
HIS B 140
GLN B 260
 None
None
None
ACT  B 601 (-3.7A)
None
 1.36A 1tw4A-4bkxB:
undetectable		 1tw4A-4bkxB:
14.25
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.
1TW4_B_CHDB1131_0
(FATTY ACID-BINDING
PROTEIN)		 4bkx METASTASIS-ASSOCIATE
D PROTEIN MTA1
HISTONE DEACETYLASE
1
(Homo
sapiens;
Homo
sapiens) 		5 / 10 ASN B 225
THR B 208
LYS A 165
HIS B 140
GLN B 260
 None
None
None
ACT  B 601 (-3.7A)
None
 1.40A 1tw4B-4bkxB:
undetectable		 1tw4B-4bkxB:
14.25
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.
1ZZ1_A_SHHA2452_1
(HISTONE
DEACETYLASE-LIKE
AMIDOHYDROLASE)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		9 / 11 HIS B 140
HIS B 141
PHE B 150
ASP B 176
HIS B 178
PHE B 205
ASP B 264
GLY B 301
TYR B 303
 ACT  B 601 (-3.7A)
ACT  B 601 (-3.8A)
None
ZN  B 600 (-2.2A)
ZN  B 600 (-3.3A)
None
ZN  B 600 ( 2.5A)
ACT  B 601 (-3.4A)
ACT  B 601 ( 4.7A)
 0.58A 1zz1A-4bkxB:
43.4		 1zz1A-4bkxB:
23.53
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.
1ZZ1_B_SHHB2552_1
(HISTONE
DEACETYLASE-LIKE
AMIDOHYDROLASE)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		9 / 12 HIS B 140
HIS B 141
PHE B 150
ASP B 176
HIS B 178
PHE B 205
ASP B 264
GLY B 301
TYR B 303
 ACT  B 601 (-3.7A)
ACT  B 601 (-3.8A)
None
ZN  B 600 (-2.2A)
ZN  B 600 (-3.3A)
None
ZN  B 600 ( 2.5A)
ACT  B 601 (-3.4A)
ACT  B 601 ( 4.7A)
 0.50A 1zz1B-4bkxB:
43.9
1zz1C-4bkxB:
43.7		 1zz1B-4bkxB:
23.53
1zz1C-4bkxB:
23.53
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.
1ZZ1_C_SHHC2652_1
(HISTONE
DEACETYLASE-LIKE
AMIDOHYDROLASE)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		6 / 12 ASP B  99
HIS B 140
HIS B 141
GLY B 149
ASP B 176
GLY B 300
 None
ACT  B 601 (-3.7A)
ACT  B 601 (-3.8A)
None
ZN  B 600 (-2.2A)
ACT  B 601 ( 4.8A)
 1.15A 1zz1C-4bkxB:
43.7		 1zz1C-4bkxB:
23.53
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.
1ZZ1_C_SHHC2652_1
(HISTONE
DEACETYLASE-LIKE
AMIDOHYDROLASE)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		7 / 12 ASP B  99
HIS B 140
HIS B 141
GLY B 149
ASP B 176
PHE B 205
GLY B 301
 None
ACT  B 601 (-3.7A)
ACT  B 601 (-3.8A)
None
ZN  B 600 (-2.2A)
None
ACT  B 601 (-3.4A)
 1.16A 1zz1C-4bkxB:
43.7		 1zz1C-4bkxB:
23.53
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.
1ZZ1_C_SHHC2652_1
(HISTONE
DEACETYLASE-LIKE
AMIDOHYDROLASE)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		9 / 12 HIS B 140
HIS B 141
GLY B 149
ASP B 176
HIS B 178
PHE B 205
ASP B 264
GLY B 301
TYR B 303
 ACT  B 601 (-3.7A)
ACT  B 601 (-3.8A)
None
ZN  B 600 (-2.2A)
ZN  B 600 (-3.3A)
None
ZN  B 600 ( 2.5A)
ACT  B 601 (-3.4A)
ACT  B 601 ( 4.7A)
 0.58A 1zz1C-4bkxB:
43.7		 1zz1C-4bkxB:
23.53
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.
1ZZ1_D_SHHD2752_1
(HISTONE
DEACETYLASE-LIKE
AMIDOHYDROLASE)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		8 / 9 HIS B 140
HIS B 141
PHE B 150
ASP B 176
HIS B 178
PHE B 205
ASP B 264
TYR B 303
 ACT  B 601 (-3.7A)
ACT  B 601 (-3.8A)
None
ZN  B 600 (-2.2A)
ZN  B 600 (-3.3A)
None
ZN  B 600 ( 2.5A)
ACT  B 601 ( 4.7A)
 0.58A 1zz1D-4bkxB:
43.7		 1zz1D-4bkxB:
23.53
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.
2QD5_A_CHDA702_0
(FERROCHELATASE)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		3 / 3 LEU B 293
PRO B 294
ARG B 169
 None
 0.51A 2qd5A-4bkxB:
undetectable		 2qd5A-4bkxB:
21.58
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.
2UXP_B_CLMB1211_0
(HTH-TYPE
TRANSCRIPTIONAL
REGULATOR TTGR)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		5 / 11 VAL B 257
CYH B 261
GLY B 262
ILE B 175
VAL B 288
 None
 1.20A 2uxpB-4bkxB:
undetectable		 2uxpB-4bkxB:
16.74
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.
2W8Y_A_486A1000_1
(PROGESTERONE
RECEPTOR)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		5 / 12 LEU B 139
GLY B 138
ARG B  34
PHE B 205
VAL B 258
 None
 1.36A 2w8yA-4bkxB:
undetectable		 2w8yA-4bkxB:
19.83
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.
3B2R_A_VDNA1_1
(CGMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		5 / 12 HIS B  68
LEU B 161
ALA B 159
ILE B 160
PHE B 187
 None
 1.06A 3b2rA-4bkxB:
undetectable		 3b2rA-4bkxB:
20.55
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.
3B2R_B_VDNB1_1
(CGMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		5 / 11 HIS B  68
LEU B 161
ALA B 159
ILE B 160
PHE B 187
 None
 1.10A 3b2rB-4bkxB:
undetectable		 3b2rB-4bkxB:
20.55
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.
3BGR_A_T27A556_1
(REVERSE
TRANSCRIPTASE/RIBONU
CLEASE H
P51 RT)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		5 / 11 LEU B  41
ASN B  44
PHE B 334
LEU B 328
TYR B  45
 None
 1.46A 3bgrA-4bkxB:
0.5
3bgrB-4bkxB:
undetectable		 3bgrA-4bkxB:
20.64
3bgrB-4bkxB:
24.07
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)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		5 / 5 HIS B 140
HIS B 141
ASP B 176
HIS B 178
ASP B 264
 ACT  B 601 (-3.7A)
ACT  B 601 (-3.8A)
ZN  B 600 (-2.2A)
ZN  B 600 (-3.3A)
ZN  B 600 ( 2.5A)
 0.26A 3c0zA-4bkxB:
41.3		 3c0zA-4bkxB:
23.43
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)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		5 / 8 HIS B 140
HIS B 141
ASP B 176
ASP B 264
GLY B 262
 ACT  B 601 (-3.7A)
ACT  B 601 (-3.8A)
ZN  B 600 (-2.2A)
ZN  B 600 ( 2.5A)
None
 1.42A 3c0zB-4bkxB:
41.5		 3c0zB-4bkxB:
23.43
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)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		4 / 8 HIS B 140
HIS B 141
ASP B 176
GLY B 300
 ACT  B 601 (-3.7A)
ACT  B 601 (-3.8A)
ZN  B 600 (-2.2A)
ACT  B 601 ( 4.8A)
 0.77A 3c0zB-4bkxB:
41.5		 3c0zB-4bkxB:
23.43
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)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		8 / 8 HIS B 140
HIS B 141
PHE B 150
ASP B 176
HIS B 178
PHE B 205
ASP B 264
GLY B 301
 ACT  B 601 (-3.7A)
ACT  B 601 (-3.8A)
None
ZN  B 600 (-2.2A)
ZN  B 600 (-3.3A)
None
ZN  B 600 ( 2.5A)
ACT  B 601 (-3.4A)
 0.37A 3c0zB-4bkxB:
41.5		 3c0zB-4bkxB:
23.43
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)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		4 / 8 PHE B 205
ASP B 264
PHE B 150
ASP B 176
 None
ZN  B 600 ( 2.5A)
None
ZN  B 600 (-2.2A)
 0.75A 3c0zB-4bkxB:
41.5		 3c0zB-4bkxB:
23.43
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)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		5 / 6 ASP B  99
HIS B 140
HIS B 141
ASP B 176
HIS B 178
 None
ACT  B 601 (-3.7A)
ACT  B 601 (-3.8A)
ZN  B 600 (-2.2A)
ZN  B 600 (-3.3A)
 0.84A 3c0zC-4bkxB:
41.5		 3c0zC-4bkxB:
23.43
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)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		5 / 6 HIS B 140
HIS B 141
ASP B 176
HIS B 178
ASP B 264
 ACT  B 601 (-3.7A)
ACT  B 601 (-3.8A)
ZN  B 600 (-2.2A)
ZN  B 600 (-3.3A)
ZN  B 600 ( 2.5A)
 0.30A 3c0zC-4bkxB:
41.5		 3c0zC-4bkxB:
23.43
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)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		5 / 8 GLY B 301
GLY B 300
GLY B 138
HIS B 140
ILE B 156
 ACT  B 601 (-3.4A)
ACT  B 601 ( 4.8A)
None
ACT  B 601 (-3.7A)
None
 1.26A 3d41A-4bkxB:
undetectable		 3d41A-4bkxB:
18.80
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)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		3 / 3 TYR B 172
ASP B 155
HIS B 141
 None
None
ACT  B 601 (-3.8A)
 0.81A 3e23A-4bkxB:
3.2		 3e23A-4bkxB:
17.56
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.
3W9T_B_W9TB504_1
(HEMOLYTIC LECTIN
CEL-III)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		4 / 5 GLU B 184
GLY B 180
TYR B 172
GLN B 260
 None
 1.49A 3w9tB-4bkxB:
undetectable		 3w9tB-4bkxB:
20.39
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.
3W9T_G_W9TG505_1
(HEMOLYTIC LECTIN
CEL-III)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		4 / 5 GLU B 184
GLY B 180
TYR B 172
GLN B 260
 None
 1.49A 3w9tG-4bkxB:
undetectable		 3w9tG-4bkxB:
20.39
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.
4ARC_A_LEUA1001_0
(LEUCINE--TRNA LIGASE)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		4 / 7 ASP B  99
SER B 148
HIS B 178
HIS B 141
 None
None
ZN  B 600 (-3.3A)
ACT  B 601 (-3.8A)
 1.29A 4arcA-4bkxB:
undetectable		 4arcA-4bkxB:
20.14
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.
4BZ6_A_SHHA700_1
(HISTONE DEACETYLASE
8)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		7 / 10 HIS B 140
HIS B 141
ASP B 176
HIS B 178
ASP B 264
GLY B 301
TYR B 303
 ACT  B 601 (-3.7A)
ACT  B 601 (-3.8A)
ZN  B 600 (-2.2A)
ZN  B 600 (-3.3A)
ZN  B 600 ( 2.5A)
ACT  B 601 (-3.4A)
ACT  B 601 ( 4.7A)
 0.27A 4bz6A-4bkxB:
51.7		 4bz6A-4bkxB:
30.00
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.
4BZ6_B_SHHB700_1
(HISTONE DEACETYLASE
8)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		8 / 12 HIS B 140
HIS B 141
ASP B 176
HIS B 178
PHE B 205
ASP B 264
GLY B 301
TYR B 303
 ACT  B 601 (-3.7A)
ACT  B 601 (-3.8A)
ZN  B 600 (-2.2A)
ZN  B 600 (-3.3A)
None
ZN  B 600 ( 2.5A)
ACT  B 601 (-3.4A)
ACT  B 601 ( 4.7A)
 0.31A 4bz6A-4bkxB:
51.7
4bz6B-4bkxB:
51.7		 4bz6A-4bkxB:
30.00
4bz6B-4bkxB:
30.00
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.
4BZ6_C_SHHC700_1
(HISTONE DEACETYLASE
8)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		5 / 12 HIS B 140
HIS B 141
GLY B 149
ASP B 176
GLY B 300
 ACT  B 601 (-3.7A)
ACT  B 601 (-3.8A)
None
ZN  B 600 (-2.2A)
ACT  B 601 ( 4.8A)
 0.87A 4bz6C-4bkxB:
51.6		 4bz6C-4bkxB:
30.00
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.
4BZ6_C_SHHC700_1
(HISTONE DEACETYLASE
8)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		9 / 12 HIS B 140
HIS B 141
GLY B 149
ASP B 176
HIS B 178
PHE B 205
ASP B 264
GLY B 301
TYR B 303
 ACT  B 601 (-3.7A)
ACT  B 601 (-3.8A)
None
ZN  B 600 (-2.2A)
ZN  B 600 (-3.3A)
None
ZN  B 600 ( 2.5A)
ACT  B 601 (-3.4A)
ACT  B 601 ( 4.7A)
 0.30A 4bz6C-4bkxB:
51.6		 4bz6C-4bkxB:
30.00
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.
4BZ6_D_SHHD700_1
(HISTONE DEACETYLASE
8)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		7 / 10 HIS B 140
HIS B 141
ASP B 176
HIS B 178
ASP B 264
GLY B 301
TYR B 303
 ACT  B 601 (-3.7A)
ACT  B 601 (-3.8A)
ZN  B 600 (-2.2A)
ZN  B 600 (-3.3A)
ZN  B 600 ( 2.5A)
ACT  B 601 (-3.4A)
ACT  B 601 ( 4.7A)
 0.27A 4bz6D-4bkxB:
51.9		 4bz6D-4bkxB:
30.00
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_D_NCTD501_1
(CYTOCHROME P450 2A6)		 4bkx HISTONE DEACETYLASE
1
METASTASIS-ASSOCIATE
D PROTEIN MTA1
(Homo
sapiens) 		4 / 7 ASN B  44
GLY B  46
ILE A 210
LEU A 214
 None
 0.61A 4ejjD-4bkxB:
undetectable		 4ejjD-4bkxB:
22.47
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.
4FGL_A_CLQA303_0
(RIBOSYLDIHYDRONICOTI
NAMIDE DEHYDROGENASE
[QUINONE])		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		5 / 12 GLY B 300
MET B  30
VAL B 133
ILE B  35
PHE B 109
 ACT  B 601 ( 4.8A)
None
None
None
None
 1.16A 4fglA-4bkxB:
undetectable
4fglB-4bkxB:
undetectable		 4fglA-4bkxB:
20.00
4fglB-4bkxB:
20.00
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)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		5 / 12 ASP B 181
GLY B 180
ASP B 264
HIS B 178
GLY B 301
 None
None
ZN  B 600 ( 2.5A)
ZN  B 600 (-3.3A)
ACT  B 601 (-3.4A)
 1.19A 4lxzA-4bkxB:
65.2		 4lxzA-4bkxB:
93.51
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)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		5 / 12 HIS B  28
PRO B  29
ASP B 264
GLY B 302
TYR B 303
 None
None
ZN  B 600 ( 2.5A)
None
ACT  B 601 ( 4.7A)
 1.11A 4lxzA-4bkxB:
65.2		 4lxzA-4bkxB:
93.51
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)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		11 / 12 HIS B  28
PRO B  29
HIS B 140
HIS B 141
GLY B 149
PHE B 150
ASP B 176
HIS B 178
ASP B 264
GLY B 301
TYR B 303
 None
None
ACT  B 601 (-3.7A)
ACT  B 601 (-3.8A)
None
None
ZN  B 600 (-2.2A)
ZN  B 600 (-3.3A)
ZN  B 600 ( 2.5A)
ACT  B 601 (-3.4A)
ACT  B 601 ( 4.7A)
 0.27A 4lxzA-4bkxB:
65.2		 4lxzA-4bkxB:
93.51
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)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		5 / 12 HIS B 140
HIS B 141
GLY B 149
ASP B 176
GLY B 300
 ACT  B 601 (-3.7A)
ACT  B 601 (-3.8A)
None
ZN  B 600 (-2.2A)
ACT  B 601 ( 4.8A)
 0.88A 4lxzA-4bkxB:
65.2		 4lxzA-4bkxB:
93.51
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)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		11 / 12 PRO B  29
ASP B  99
HIS B 140
HIS B 141
GLY B 149
PHE B 150
ASP B 176
HIS B 178
ASP B 264
GLY B 301
TYR B 303
 None
None
ACT  B 601 (-3.7A)
ACT  B 601 (-3.8A)
None
None
ZN  B 600 (-2.2A)
ZN  B 600 (-3.3A)
ZN  B 600 ( 2.5A)
ACT  B 601 (-3.4A)
ACT  B 601 ( 4.7A)
 0.58A 4lxzA-4bkxB:
65.2		 4lxzA-4bkxB:
93.51
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)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		6 / 12 PRO B  29
HIS B 140
HIS B 178
ASP B 264
GLY B 301
TYR B 303
 None
ACT  B 601 (-3.7A)
ZN  B 600 (-3.3A)
ZN  B 600 ( 2.5A)
ACT  B 601 (-3.4A)
ACT  B 601 ( 4.7A)
 1.19A 4lxzA-4bkxB:
65.2		 4lxzA-4bkxB:
93.51
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)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		5 / 11 HIS B  28
PRO B  29
ASP B 264
GLY B 302
TYR B 303
 None
None
ZN  B 600 ( 2.5A)
None
ACT  B 601 ( 4.7A)
 1.10A 4lxzB-4bkxB:
65.2		 4lxzB-4bkxB:
93.51
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)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		10 / 11 HIS B  28
PRO B  29
HIS B 140
HIS B 141
PHE B 150
ASP B 176
HIS B 178
ASP B 264
GLY B 301
TYR B 303
 None
None
ACT  B 601 (-3.7A)
ACT  B 601 (-3.8A)
None
ZN  B 600 (-2.2A)
ZN  B 600 (-3.3A)
ZN  B 600 ( 2.5A)
ACT  B 601 (-3.4A)
ACT  B 601 ( 4.7A)
 0.28A 4lxzB-4bkxB:
65.2		 4lxzB-4bkxB:
93.51
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)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		10 / 11 PRO B  29
ASP B  99
HIS B 140
HIS B 141
PHE B 150
ASP B 176
HIS B 178
ASP B 264
GLY B 301
TYR B 303
 None
None
ACT  B 601 (-3.7A)
ACT  B 601 (-3.8A)
None
ZN  B 600 (-2.2A)
ZN  B 600 (-3.3A)
ZN  B 600 ( 2.5A)
ACT  B 601 (-3.4A)
ACT  B 601 ( 4.7A)
 0.60A 4lxzB-4bkxB:
65.2		 4lxzB-4bkxB:
93.51
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)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		6 / 12 ASP B  99
GLY B 149
PHE B 150
ASP B 264
HIS B 178
PHE B 205
 None
None
None
ZN  B 600 ( 2.5A)
ZN  B 600 (-3.3A)
None
 1.28A 4lxzC-4bkxB:
65.5		 4lxzC-4bkxB:
93.51
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)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		5 / 12 ASP B 181
GLY B 180
ASP B 264
HIS B 178
GLY B 301
 None
None
ZN  B 600 ( 2.5A)
ZN  B 600 (-3.3A)
ACT  B 601 (-3.4A)
 1.20A 4lxzC-4bkxB:
65.5		 4lxzC-4bkxB:
93.51
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)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		5 / 12 HIS B 140
HIS B 141
GLY B 149
ASP B 176
GLY B 300
 ACT  B 601 (-3.7A)
ACT  B 601 (-3.8A)
None
ZN  B 600 (-2.2A)
ACT  B 601 ( 4.8A)
 0.89A 4lxzC-4bkxB:
65.5		 4lxzC-4bkxB:
93.51
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)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		9 / 12 PRO B  29
ASP B  99
HIS B 140
HIS B 141
GLY B 149
PHE B 150
ASP B 176
HIS B 178
PHE B 205
 None
None
ACT  B 601 (-3.7A)
ACT  B 601 (-3.8A)
None
None
ZN  B 600 (-2.2A)
ZN  B 600 (-3.3A)
None
 0.64A 4lxzC-4bkxB:
65.5		 4lxzC-4bkxB:
93.51
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)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		11 / 12 PRO B  29
HIS B 140
HIS B 141
GLY B 149
PHE B 150
ASP B 176
HIS B 178
PHE B 205
ASP B 264
GLY B 301
TYR B 303
 None
ACT  B 601 (-3.7A)
ACT  B 601 (-3.8A)
None
None
ZN  B 600 (-2.2A)
ZN  B 600 (-3.3A)
None
ZN  B 600 ( 2.5A)
ACT  B 601 (-3.4A)
ACT  B 601 ( 4.7A)
 0.28A 4lxzC-4bkxB:
65.5		 4lxzC-4bkxB:
93.51
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)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		6 / 12 PRO B  29
HIS B 140
HIS B 178
ASP B 264
GLY B 301
TYR B 303
 None
ACT  B 601 (-3.7A)
ZN  B 600 (-3.3A)
ZN  B 600 ( 2.5A)
ACT  B 601 (-3.4A)
ACT  B 601 ( 4.7A)
 1.20A 4lxzC-4bkxB:
65.5		 4lxzC-4bkxB:
93.51
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)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		5 / 12 HIS B 140
HIS B 141
GLY B 149
ASP B 176
GLY B 300
 ACT  B 601 (-3.7A)
ACT  B 601 (-3.8A)
None
ZN  B 600 (-2.2A)
ACT  B 601 ( 4.8A)
 0.94A 4qa0A-4bkxB:
55.6		 4qa0A-4bkxB:
33.40
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)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		10 / 12 HIS B 140
HIS B 141
GLY B 149
PHE B 150
ASP B 176
HIS B 178
PHE B 205
ASP B 264
GLY B 301
TYR B 303
 ACT  B 601 (-3.7A)
ACT  B 601 (-3.8A)
None
None
ZN  B 600 (-2.2A)
ZN  B 600 (-3.3A)
None
ZN  B 600 ( 2.5A)
ACT  B 601 (-3.4A)
ACT  B 601 ( 4.7A)
 0.37A 4qa0A-4bkxB:
55.6		 4qa0A-4bkxB:
33.40
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)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		5 / 12 HIS B 141
HIS B 178
ASP B 264
GLY B 301
TYR B 303
 ACT  B 601 (-3.8A)
ZN  B 600 (-3.3A)
ZN  B 600 ( 2.5A)
ACT  B 601 (-3.4A)
ACT  B 601 ( 4.7A)
 0.95A 4qa0A-4bkxB:
55.6		 4qa0A-4bkxB:
33.40
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)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		5 / 11 HIS B 140
HIS B 141
PHE B 150
ASP B 176
GLY B 300
 ACT  B 601 (-3.7A)
ACT  B 601 (-3.8A)
None
ZN  B 600 (-2.2A)
ACT  B 601 ( 4.8A)
 1.14A 4qa0B-4bkxB:
55.6		 4qa0B-4bkxB:
33.40
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)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		9 / 11 HIS B 140
HIS B 141
PHE B 150
ASP B 176
HIS B 178
PHE B 205
ASP B 264
GLY B 301
TYR B 303
 ACT  B 601 (-3.7A)
ACT  B 601 (-3.8A)
None
ZN  B 600 (-2.2A)
ZN  B 600 (-3.3A)
None
ZN  B 600 ( 2.5A)
ACT  B 601 (-3.4A)
ACT  B 601 ( 4.7A)
 0.35A 4qa0B-4bkxB:
55.6		 4qa0B-4bkxB:
33.40
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)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		5 / 11 HIS B 141
HIS B 178
ASP B 264
GLY B 301
TYR B 303
 ACT  B 601 (-3.8A)
ZN  B 600 (-3.3A)
ZN  B 600 ( 2.5A)
ACT  B 601 (-3.4A)
ACT  B 601 ( 4.7A)
 0.95A 4qa0B-4bkxB:
55.6		 4qa0B-4bkxB:
33.40
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)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		5 / 11 TYR B 152
HIS B 140
HIS B 178
ASP B 264
TYR B 303
 None
ACT  B 601 (-3.7A)
ZN  B 600 (-3.3A)
ZN  B 600 ( 2.5A)
ACT  B 601 ( 4.7A)
 1.49A 4qa0B-4bkxB:
55.6		 4qa0B-4bkxB:
33.40
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)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		10 / 12 HIS B 140
HIS B 141
GLY B 149
PHE B 150
ASP B 176
HIS B 178
PHE B 205
ASP B 264
GLY B 301
TYR B 303
 ACT  B 601 (-3.7A)
ACT  B 601 (-3.8A)
None
None
ZN  B 600 (-2.2A)
ZN  B 600 (-3.3A)
None
ZN  B 600 ( 2.5A)
ACT  B 601 (-3.4A)
ACT  B 601 ( 4.7A)
 0.32A 4qa2A-4bkxB:
54.8		 4qa2A-4bkxB:
33.40
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)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		7 / 12 HIS B 140
HIS B 141
GLY B 149
PHE B 150
ASP B 176
PHE B 205
GLY B 300
 ACT  B 601 (-3.7A)
ACT  B 601 (-3.8A)
None
None
ZN  B 600 (-2.2A)
None
ACT  B 601 ( 4.8A)
 1.11A 4qa2A-4bkxB:
54.8		 4qa2A-4bkxB:
33.40
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)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		5 / 12 HIS B 141
HIS B 178
ASP B 264
GLY B 301
TYR B 303
 ACT  B 601 (-3.8A)
ZN  B 600 (-3.3A)
ZN  B 600 ( 2.5A)
ACT  B 601 (-3.4A)
ACT  B 601 ( 4.7A)
 0.96A 4qa2A-4bkxB:
54.8		 4qa2A-4bkxB:
33.40
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)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		10 / 12 HIS B 140
HIS B 141
GLY B 149
PHE B 150
ASP B 176
HIS B 178
PHE B 205
ASP B 264
GLY B 301
TYR B 303
 ACT  B 601 (-3.7A)
ACT  B 601 (-3.8A)
None
None
ZN  B 600 (-2.2A)
ZN  B 600 (-3.3A)
None
ZN  B 600 ( 2.5A)
ACT  B 601 (-3.4A)
ACT  B 601 ( 4.7A)
 0.31A 4qa2B-4bkxB:
56.0		 4qa2B-4bkxB:
33.40
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)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		7 / 12 HIS B 140
HIS B 141
GLY B 149
PHE B 150
ASP B 176
PHE B 205
GLY B 300
 ACT  B 601 (-3.7A)
ACT  B 601 (-3.8A)
None
None
ZN  B 600 (-2.2A)
None
ACT  B 601 ( 4.8A)
 1.11A 4qa2B-4bkxB:
56.0		 4qa2B-4bkxB:
33.40
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)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		5 / 12 HIS B 141
HIS B 178
ASP B 264
GLY B 301
TYR B 303
 ACT  B 601 (-3.8A)
ZN  B 600 (-3.3A)
ZN  B 600 ( 2.5A)
ACT  B 601 (-3.4A)
ACT  B 601 ( 4.7A)
 0.95A 4qa2B-4bkxB:
56.0		 4qa2B-4bkxB:
33.40
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)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		5 / 12 PHE B 150
HIS B 178
ASP B 264
GLY B 302
TYR B 303
 None
ZN  B 600 (-3.3A)
ZN  B 600 ( 2.5A)
None
ACT  B 601 ( 4.7A)
 1.22A 4qa2B-4bkxB:
56.0		 4qa2B-4bkxB:
33.40
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.
5EEI_A_SHHA2004_1
(HDAC6 PROTEIN)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		11 / 12 PRO B  29
HIS B 140
HIS B 141
GLY B 149
PHE B 150
ASP B 176
HIS B 178
PHE B 205
ASP B 264
LEU B 271
TYR B 303
 None
ACT  B 601 (-3.7A)
ACT  B 601 (-3.8A)
None
None
ZN  B 600 (-2.2A)
ZN  B 600 (-3.3A)
None
ZN  B 600 ( 2.5A)
None
ACT  B 601 ( 4.7A)
 0.45A 5eeiA-4bkxB:
42.9		 5eeiA-4bkxB:
25.15
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)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		6 / 12 PRO B  29
HIS B 140
HIS B 178
ASP B 264
LEU B 271
TYR B 303
 None
ACT  B 601 (-3.7A)
ZN  B 600 (-3.3A)
ZN  B 600 ( 2.5A)
None
ACT  B 601 ( 4.7A)
 1.16A 5eeiA-4bkxB:
42.9		 5eeiA-4bkxB:
25.15
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)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		5 / 12 SER B 148
HIS B 140
HIS B 178
ASP B 264
TYR B 303
 None
ACT  B 601 (-3.7A)
ZN  B 600 (-3.3A)
ZN  B 600 ( 2.5A)
ACT  B 601 ( 4.7A)
 1.19A 5eeiA-4bkxB:
42.9		 5eeiA-4bkxB:
25.15
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)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		11 / 12 PRO B  29
HIS B 140
HIS B 141
GLY B 149
PHE B 150
ASP B 176
HIS B 178
PHE B 205
ASP B 264
LEU B 271
TYR B 303
 None
ACT  B 601 (-3.7A)
ACT  B 601 (-3.8A)
None
None
ZN  B 600 (-2.2A)
ZN  B 600 (-3.3A)
None
ZN  B 600 ( 2.5A)
None
ACT  B 601 ( 4.7A)
 0.44A 5eeiB-4bkxB:
42.9		 5eeiB-4bkxB:
25.15
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)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		6 / 12 PRO B  29
HIS B 140
HIS B 178
ASP B 264
LEU B 271
TYR B 303
 None
ACT  B 601 (-3.7A)
ZN  B 600 (-3.3A)
ZN  B 600 ( 2.5A)
None
ACT  B 601 ( 4.7A)
 1.15A 5eeiB-4bkxB:
42.9		 5eeiB-4bkxB:
25.15
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)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		5 / 12 SER B 148
HIS B 140
HIS B 178
ASP B 264
TYR B 303
 None
ACT  B 601 (-3.7A)
ZN  B 600 (-3.3A)
ZN  B 600 ( 2.5A)
ACT  B 601 ( 4.7A)
 1.17A 5eeiB-4bkxB:
42.9		 5eeiB-4bkxB:
25.15
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)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		5 / 12 HIS B  28
HIS B 178
ASP B 264
GLY B 302
TYR B 303
 None
ZN  B 600 (-3.3A)
ZN  B 600 ( 2.5A)
None
ACT  B 601 ( 4.7A)
 1.25A 5eenA-4bkxB:
43.2		 5eenA-4bkxB:
25.15
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)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		11 / 12 HIS B  28
PRO B  29
HIS B 140
HIS B 141
PHE B 150
ASP B 176
HIS B 178
PHE B 205
ASP B 264
GLY B 301
TYR B 303
 None
None
ACT  B 601 (-3.7A)
ACT  B 601 (-3.8A)
None
ZN  B 600 (-2.2A)
ZN  B 600 (-3.3A)
None
ZN  B 600 ( 2.5A)
ACT  B 601 (-3.4A)
ACT  B 601 ( 4.7A)
 0.48A 5eenA-4bkxB:
43.2		 5eenA-4bkxB:
25.15
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)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		6 / 12 PRO B  29
HIS B 140
HIS B 178
ASP B 264
GLY B 301
TYR B 303
 None
ACT  B 601 (-3.7A)
ZN  B 600 (-3.3A)
ZN  B 600 ( 2.5A)
ACT  B 601 (-3.4A)
ACT  B 601 ( 4.7A)
 1.14A 5eenA-4bkxB:
43.2		 5eenA-4bkxB:
25.15
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)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		6 / 12 SER B 148
HIS B 140
HIS B 178
ASP B 264
GLY B 301
TYR B 303
 None
ACT  B 601 (-3.7A)
ZN  B 600 (-3.3A)
ZN  B 600 ( 2.5A)
ACT  B 601 (-3.4A)
ACT  B 601 ( 4.7A)
 1.15A 5eenA-4bkxB:
43.2		 5eenA-4bkxB:
25.15
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)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		6 / 12 SER B 148
HIS B 178
PHE B 205
ASP B 264
GLY B 301
TYR B 303
 None
ZN  B 600 (-3.3A)
None
ZN  B 600 ( 2.5A)
ACT  B 601 (-3.4A)
ACT  B 601 ( 4.7A)
 1.34A 5eenA-4bkxB:
43.2		 5eenA-4bkxB:
25.15
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)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		11 / 12 HIS B  28
PRO B  29
HIS B 140
HIS B 141
PHE B 150
ASP B 176
HIS B 178
PHE B 205
ASP B 264
LEU B 271
TYR B 303
 None
None
ACT  B 601 (-3.7A)
ACT  B 601 (-3.8A)
None
ZN  B 600 (-2.2A)
ZN  B 600 (-3.3A)
None
ZN  B 600 ( 2.5A)
None
ACT  B 601 ( 4.7A)
 0.50A 5eenB-4bkxB:
43.2		 5eenB-4bkxB:
25.15
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)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		6 / 12 PRO B  29
HIS B 140
HIS B 178
ASP B 264
LEU B 271
TYR B 303
 None
ACT  B 601 (-3.7A)
ZN  B 600 (-3.3A)
ZN  B 600 ( 2.5A)
None
ACT  B 601 ( 4.7A)
 1.11A 5eenB-4bkxB:
43.2		 5eenB-4bkxB:
25.15
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)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		5 / 12 SER B 148
HIS B 140
HIS B 178
ASP B 264
TYR B 303
 None
ACT  B 601 (-3.7A)
ZN  B 600 (-3.3A)
ZN  B 600 ( 2.5A)
ACT  B 601 ( 4.7A)
 1.15A 5eenB-4bkxB:
43.2		 5eenB-4bkxB:
25.15
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)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		5 / 12 SER B 148
HIS B 178
PHE B 205
ASP B 264
TYR B 303
 None
ZN  B 600 (-3.3A)
None
ZN  B 600 ( 2.5A)
ACT  B 601 ( 4.7A)
 1.39A 5eenB-4bkxB:
43.2		 5eenB-4bkxB:
25.15
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)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		10 / 12 HIS B  28
PRO B  29
HIS B 140
HIS B 141
PHE B 150
ASP B 176
HIS B 178
PHE B 205
ASP B 264
TYR B 303
 None
None
ACT  B 601 (-3.7A)
ACT  B 601 (-3.8A)
None
ZN  B 600 (-2.2A)
ZN  B 600 (-3.3A)
None
ZN  B 600 ( 2.5A)
ACT  B 601 ( 4.7A)
 0.48A 5ef8A-4bkxB:
43.0		 5ef8A-4bkxB:
25.15
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)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		5 / 12 PRO B  29
HIS B 140
HIS B 178
ASP B 264
TYR B 303
 None
ACT  B 601 (-3.7A)
ZN  B 600 (-3.3A)
ZN  B 600 ( 2.5A)
ACT  B 601 ( 4.7A)
 1.14A 5ef8A-4bkxB:
43.0		 5ef8A-4bkxB:
25.15
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)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		5 / 12 SER B 148
HIS B 140
HIS B 178
ASP B 264
TYR B 303
 None
ACT  B 601 (-3.7A)
ZN  B 600 (-3.3A)
ZN  B 600 ( 2.5A)
ACT  B 601 ( 4.7A)
 1.18A 5ef8A-4bkxB:
43.0		 5ef8A-4bkxB:
25.15
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)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		5 / 12 SER B 148
HIS B 178
PHE B 205
ASP B 264
TYR B 303
 None
ZN  B 600 (-3.3A)
None
ZN  B 600 ( 2.5A)
ACT  B 601 ( 4.7A)
 1.31A 5ef8A-4bkxB:
43.0		 5ef8A-4bkxB:
25.15
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)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		10 / 12 PRO B  29
HIS B 140
HIS B 141
PHE B 150
ASP B 176
HIS B 178
PHE B 205
ASP B 264
LEU B 271
TYR B 303
 None
ACT  B 601 (-3.7A)
ACT  B 601 (-3.8A)
None
ZN  B 600 (-2.2A)
ZN  B 600 (-3.3A)
None
ZN  B 600 ( 2.5A)
None
ACT  B 601 ( 4.7A)
 0.42A 5ef8B-4bkxB:
43.2		 5ef8B-4bkxB:
25.15
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)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		6 / 12 PRO B  29
HIS B 140
HIS B 178
ASP B 264
LEU B 271
TYR B 303
 None
ACT  B 601 (-3.7A)
ZN  B 600 (-3.3A)
ZN  B 600 ( 2.5A)
None
ACT  B 601 ( 4.7A)
 1.08A 5ef8B-4bkxB:
43.2		 5ef8B-4bkxB:
25.15
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)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		5 / 12 SER B 148
HIS B 140
HIS B 178
ASP B 264
TYR B 303
 None
ACT  B 601 (-3.7A)
ZN  B 600 (-3.3A)
ZN  B 600 ( 2.5A)
ACT  B 601 ( 4.7A)
 1.16A 5ef8B-4bkxB:
43.2		 5ef8B-4bkxB:
25.15
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)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		5 / 12 SER B 148
HIS B 178
PHE B 205
ASP B 264
TYR B 303
 None
ZN  B 600 (-3.3A)
None
ZN  B 600 ( 2.5A)
ACT  B 601 ( 4.7A)
 1.37A 5ef8B-4bkxB:
43.2		 5ef8B-4bkxB:
25.15
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.
5G5G_A_ACTA1231_0
(PUTATIVE XANTHINE
DEHYDROGENASE YAGR
MOLYBDENUM-BINDING
SU SUBUNIT
PUTATIVE XANTHINE
DEHYDROGENASE YAGT
IRON-SULFUR-BINDING
SUBUNIT)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		3 / 3 ARG B   8
THR B 322
ASP B 321
 None
 0.84A 5g5gA-4bkxB:
undetectable
5g5gB-4bkxB:
undetectable		 5g5gA-4bkxB:
18.24
5g5gB-4bkxB:
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.
5JQ7_B_T0RB705_2
(ENVELOPE
GLYCOPROTEIN 2)		 4bkx HISTONE DEACETYLASE
1
METASTASIS-ASSOCIATE
D PROTEIN MTA1
(Homo
sapiens) 		4 / 7 TYR B 336
THR A 332
THR A 333
LEU B  41
 None
 1.12A 5jq7B-4bkxB:
undetectable		 5jq7B-4bkxB:
14.14
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.
5M35_B_BEZB302_0
(14-3-3 PROTEIN
ZETA/DELTA)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		3 / 3 MET B 249
GLN B 253
ARG B 169
 None
 1.13A 5m35B-4bkxB:
undetectable		 5m35B-4bkxB:
19.38
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.
5NFP_A_8W5A804_2
(GLUCOCORTICOID
RECEPTOR)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		4 / 4 LEU B 293
MET B 245
ILE B 131
LEU B 259
 None
 1.31A 5nfpA-4bkxB:
undetectable		 5nfpA-4bkxB:
17.67
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.
5O96_D_SAMD501_0
(RIBOSOMAL RNA SMALL
SUBUNIT
METHYLTRANSFERASE E)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		5 / 10 HIS B 178
ILE B 175
GLY B 262
GLY B 301
LEU B 276
 ZN  B 600 (-3.3A)
None
None
ACT  B 601 (-3.4A)
None
 1.02A 5o96C-4bkxB:
undetectable
5o96D-4bkxB:
undetectable		 5o96C-4bkxB:
20.00
5o96D-4bkxB:
20.00
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.
6FNA_B_BEZB302_0
(14-3-3 PROTEIN
ZETA/DELTA)		 4bkx HISTONE DEACETYLASE
1
(Homo
sapiens) 		3 / 3 MET B 249
GLN B 253
ARG B 169
 None
 1.15A 6fnaB-4bkxB:
undetectable		 6fnaB-4bkxB:
18.98
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.
6MB5_A_NMYA301_0
(AAC(3)-IIIB PROTEIN)		 4bkx METASTASIS-ASSOCIATE
D PROTEIN MTA1
HISTONE DEACETYLASE
1
(Homo
sapiens;
Homo
sapiens) 		5 / 11 TYR B  48
ASP B 332
HIS B  39
GLY B  17
GLU A 325
 None
 1.43A 6mb5A-4bkxB:
undetectable		 6mb5A-4bkxB:
11.94
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.
6MB9_A_NMYA303_0
(AAC(3)-IIIB PROTEIN)		 4bkx METASTASIS-ASSOCIATE
D PROTEIN MTA1
HISTONE DEACETYLASE
1
(Homo
sapiens;
Homo
sapiens) 		5 / 10 ASP A 256
ASP B 332
HIS B  39
GLY B  17
GLU A 325
 None
 1.35A 6mb9A-4bkxA:
undetectable		 6mb9A-4bkxA:
17.05
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.
6MB9_A_NMYA303_0
(AAC(3)-IIIB PROTEIN)		 4bkx METASTASIS-ASSOCIATE
D PROTEIN MTA1
HISTONE DEACETYLASE
1
(Homo
sapiens;
Homo
sapiens) 		5 / 10 TYR B  48
ASP B 332
HIS B  39
GLY B  17
GLU A 325
 None
 1.47A 6mb9A-4bkxB:
undetectable		 6mb9A-4bkxB:
11.94
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.
6MB9_B_NMYB302_0
(AAC(3)-IIIB PROTEIN)		 4bkx METASTASIS-ASSOCIATE
D PROTEIN MTA1
HISTONE DEACETYLASE
1
(Homo
sapiens;
Homo
sapiens) 		5 / 10 ASP A 256
ASP B 332
HIS B  39
GLY B  17
GLU A 325
 None
 1.31A 6mb9B-4bkxA:
undetectable		 6mb9B-4bkxA:
17.05
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.
6MB9_B_NMYB302_0
(AAC(3)-IIIB PROTEIN)		 4bkx METASTASIS-ASSOCIATE
D PROTEIN MTA1
HISTONE DEACETYLASE
1
(Homo
sapiens;
Homo
sapiens) 		5 / 10 TYR B  48
ASP B 332
HIS B  39
GLY B  17
GLU A 325
 None
 1.41A 6mb9B-4bkxB:
undetectable		 6mb9B-4bkxB:
11.94
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.
6MB9_C_NMYC302_0
(AAC(3)-IIIB PROTEIN)		 4bkx METASTASIS-ASSOCIATE
D PROTEIN MTA1
HISTONE DEACETYLASE
1
(Homo
sapiens;
Homo
sapiens) 		5 / 10 ASP A 256
ASP B 332
HIS B  39
GLY B  17
GLU A 325
 None
 1.32A 6mb9C-4bkxA:
undetectable		 6mb9C-4bkxA:
17.05
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.
6MB9_C_NMYC302_0
(AAC(3)-IIIB PROTEIN)		 4bkx METASTASIS-ASSOCIATE
D PROTEIN MTA1
HISTONE DEACETYLASE
1
(Homo
sapiens;
Homo
sapiens) 		5 / 10 TYR B  48
ASP B 332
HIS B  39
GLY B  17
GLU A 325
 None
 1.37A 6mb9C-4bkxB:
undetectable		 6mb9C-4bkxB:
11.94