SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '1okg'

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.
1CRB_A_RTLA200_0
(CELLULAR RETINOL
BINDING PROTEIN)		 1okg POSSIBLE
3-MERCAPTOPYRUVATE
SULFURTRANSFERASE
(Leishmania
major) 		5 / 12 PHE A 162
LEU A 120
LEU A 117
LEU A  64
ILE A  84
 CSR  A  80 ( 3.5A)
None
None
None
CSR  A  80 ( 3.6A)
 1.14A 1crbA-1okgA:
undetectable		 1crbA-1okgA:
15.93
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.
1XOZ_A_CIAA501_1
(CGMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE)		 1okg POSSIBLE
3-MERCAPTOPYRUVATE
SULFURTRANSFERASE
(Leishmania
major) 		5 / 12 TYR A 101
ALA A  55
ILE A  56
ILE A  30
LEU A  64
 None
 1.03A 1xozA-1okgA:
undetectable		 1xozA-1okgA:
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.
2UXP_A_CLMA1211_0
(HTH-TYPE
TRANSCRIPTIONAL
REGULATOR TTGR)		 1okg POSSIBLE
3-MERCAPTOPYRUVATE
SULFURTRANSFERASE
(Leishmania
major) 		5 / 8 ALA A 122
LEU A 117
LEU A 113
VAL A  31
ILE A  30
 None
 1.45A 2uxpA-1okgA:
undetectable		 2uxpA-1okgA:
17.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3O7W_A_SAMA801_1
(LEUCINE CARBOXYL
METHYLTRANSFERASE 1)		 1okg POSSIBLE
3-MERCAPTOPYRUVATE
SULFURTRANSFERASE
(Leishmania
major) 		3 / 3 LYS A 197
ARG A  74
ASP A 179
 None
SO3  A1374 (-2.0A)
None
 1.24A 3o7wA-1okgA:
undetectable		 3o7wA-1okgA:
19.33
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.
3OU6_C_SAMC300_1
(SAM-DEPENDENT
METHYLTRANSFERASE)		 1okg POSSIBLE
3-MERCAPTOPYRUVATE
SULFURTRANSFERASE
(Leishmania
major) 		3 / 3 TYR A 193
GLY A 312
ASP A 313
 None
 0.64A 3ou6C-1okgA:
undetectable		 3ou6C-1okgA:
19.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3TJ7_A_ACTA604_0
(GBAA_1210 PROTEIN)		 1okg POSSIBLE
3-MERCAPTOPYRUVATE
SULFURTRANSFERASE
(Leishmania
major) 		5 / 6 GLY A 254
VAL A 257
HIS A  75
SER A 255
THR A 258
 SO3  A1374 (-3.3A)
None
None
SO3  A1374 (-3.5A)
SO3  A1374 ( 4.5A)
 1.31A 3tj7A-1okgA:
0.0
3tj7B-1okgA:
0.0		 3tj7A-1okgA:
17.20
3tj7B-1okgA:
17.20
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.
3TJ7_C_ACTC606_0
(GBAA_1210 PROTEIN)		 1okg POSSIBLE
3-MERCAPTOPYRUVATE
SULFURTRANSFERASE
(Leishmania
major) 		5 / 6 GLY A 254
VAL A 257
HIS A  75
SER A 255
THR A 258
 SO3  A1374 (-3.3A)
None
None
SO3  A1374 (-3.5A)
SO3  A1374 ( 4.5A)
 1.31A 3tj7C-1okgA:
0.0
3tj7D-1okgA:
0.5		 3tj7C-1okgA:
17.20
3tj7D-1okgA:
17.20
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.
3TJ7_D_ACTD605_0
(GBAA_1210 PROTEIN)		 1okg POSSIBLE
3-MERCAPTOPYRUVATE
SULFURTRANSFERASE
(Leishmania
major) 		5 / 6 VAL A 257
HIS A  75
SER A 255
THR A 258
GLY A 254
 None
None
SO3  A1374 (-3.5A)
SO3  A1374 ( 4.5A)
SO3  A1374 (-3.3A)
 1.31A 3tj7C-1okgA:
0.0
3tj7D-1okgA:
0.5		 3tj7C-1okgA:
17.20
3tj7D-1okgA:
17.20
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.
3V8V_B_SAMB801_0
(RIBOSOMAL RNA LARGE
SUBUNIT
METHYLTRANSFERASE L)		 1okg POSSIBLE
3-MERCAPTOPYRUVATE
SULFURTRANSFERASE
(Leishmania
major) 		5 / 11 MET A  92
GLY A  94
ASP A 123
VAL A  31
LEU A 113
 None
 1.18A 3v8vB-1okgA:
0.6		 3v8vB-1okgA:
18.93
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.
4B53_B_ACTB1445_0
(IG GAMMA-4 CHAIN C
REGION)		 1okg POSSIBLE
3-MERCAPTOPYRUVATE
SULFURTRANSFERASE
(Leishmania
major) 		3 / 3 GLU A 283
GLY A 279
SER A  71
 None
 0.65A 4b53B-1okgA:
undetectable		 4b53B-1okgA:
15.58
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.
5IGY_A_ERYA403_0
(MACROLIDE
2'-PHOSPHOTRANSFERAS
E II)		 1okg POSSIBLE
3-MERCAPTOPYRUVATE
SULFURTRANSFERASE
(Leishmania
major) 		5 / 12 ILE A 177
GLY A 204
ALA A 180
ILE A 292
PHE A 288
 None
 1.17A 5igyA-1okgA:
undetectable		 5igyA-1okgA:
20.26
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.
5KPR_A_PAUA404_0
(PANTOTHENATE KINASE
3)		 1okg POSSIBLE
3-MERCAPTOPYRUVATE
SULFURTRANSFERASE
(Leishmania
major) 		4 / 5 GLY A 279
SER A 282
ARG A  74
GLY A 254
 None
None
SO3  A1374 (-2.0A)
SO3  A1374 (-3.3A)
 0.98A 5kprA-1okgA:
undetectable		 5kprA-1okgA:
22.04
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.
5TE0_A_XINA401_2
(AP2-ASSOCIATED
PROTEIN KINASE 1)		 1okg POSSIBLE
3-MERCAPTOPYRUVATE
SULFURTRANSFERASE
(Leishmania
major) 		4 / 5 LEU A  64
VAL A  60
MET A 108
CYH A 111
 None
None
SO3  A1374 ( 4.7A)
None
 1.44A 5te0A-1okgA:
undetectable		 5te0A-1okgA:
23.15
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.
5V0V_A_8QPA613_1
(SERUM ALBUMIN)		 1okg POSSIBLE
3-MERCAPTOPYRUVATE
SULFURTRANSFERASE
(Leishmania
major) 		4 / 8 ALA A 259
SER A 182
THR A 211
GLY A 254
 None
None
None
SO3  A1374 (-3.3A)
 0.91A 5v0vA-1okgA:
undetectable		 5v0vA-1okgA:
19.56
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.
6C2M_B_SUEB1202_1
(NS3 PROTEASE)		 1okg POSSIBLE
3-MERCAPTOPYRUVATE
SULFURTRANSFERASE
(Leishmania
major) 		5 / 9 ASP A 103
LEU A 113
ARG A  34
ALA A  58
ASP A  32
 None
 1.15A 6c2mB-1okgA:
undetectable		 6c2mB-1okgA:
15.57
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.
6CJK_C_ACTC301_0
(IMMUNOGLOBULIN FAB
LIGHT CHAIN)		 1okg POSSIBLE
3-MERCAPTOPYRUVATE
SULFURTRANSFERASE
(Leishmania
major) 		4 / 4 VAL A 126
GLY A 110
ASP A 102
ASP A  32
 None
 1.42A 6cjkC-1okgA:
undetectable		 6cjkC-1okgA:
19.47