SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '2r94'

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.
1HK2_A_T44A3004_1
(SERUM ALBUMIN)		 2r94 2-KETO-3-DEOXY-(6-PH
OSPHO-)GLUCONATE
ALDOLASE
(Thermoproteus
tenax) 		4 / 7 ALA A  99
GLU A  98
LEU A 102
VAL A  89
 None
 0.94A 1hk2A-2r94A:
undetectable		 1hk2A-2r94A:
17.35
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.
1KLM_A_SPPA999_1
(HIV-1 REVERSE
TRANSCRIPTASE)		 2r94 2-KETO-3-DEOXY-(6-PH
OSPHO-)GLUCONATE
ALDOLASE
(Thermoproteus
tenax) 		5 / 11 LEU A 293
TYR A 220
PRO A 284
LEU A 285
PRO A 287
 None
 1.36A 1klmA-2r94A:
undetectable		 1klmA-2r94A:
20.29
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.
1N2X_A_SAMA401_0
(S-ADENOSYL-METHYLTRA
NSFERASE MRAW)		 2r94 2-KETO-3-DEOXY-(6-PH
OSPHO-)GLUCONATE
ALDOLASE
(Thermoproteus
tenax) 		5 / 12 THR A 175
VAL A 214
VAL A 202
TYR A 148
ARG A 255
 PYR  A 999 ( 4.4A)
None
None
PYR  A 999 (-4.5A)
None
 1.23A 1n2xA-2r94A:
undetectable		 1n2xA-2r94A:
22.82
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.
2AOU_B_CQAB401_0
(HISTAMINE
N-METHYLTRANSFERASE)		 2r94 2-KETO-3-DEOXY-(6-PH
OSPHO-)GLUCONATE
ALDOLASE
(Thermoproteus
tenax) 		4 / 7 GLY A  34
PHE A  31
PRO A 278
THR A  29
 None
 1.15A 2aouB-2r94A:
undetectable		 2aouB-2r94A:
22.59
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.
2F8G_B_017B401_2
(POL POLYPROTEIN)		 2r94 2-KETO-3-DEOXY-(6-PH
OSPHO-)GLUCONATE
ALDOLASE
(Thermoproteus
tenax) 		6 / 12 LEU A 225
ASP A 236
VAL A 232
ILE A 237
VAL A 202
ILE A 228
 None
 1.40A 2f8gB-2r94A:
undetectable		 2f8gB-2r94A:
15.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3BJW_H_SVRH511_2
(PHOSPHOLIPASE A2)		 2r94 2-KETO-3-DEOXY-(6-PH
OSPHO-)GLUCONATE
ALDOLASE
(Thermoproteus
tenax) 		4 / 5 VAL A  56
VAL A  55
THR A  77
THR A  49
 None
 1.28A 3bjwD-2r94A:
undetectable		 3bjwD-2r94A:
17.19
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.
3ELZ_A_CHDA150_0
(ILEAL BILE
ACID-BINDING PROTEIN)		 2r94 2-KETO-3-DEOXY-(6-PH
OSPHO-)GLUCONATE
ALDOLASE
(Thermoproteus
tenax) 		5 / 12 ASN A  47
THR A  49
VAL A  53
LEU A  40
THR A  30
 None
 1.30A 3elzA-2r94A:
undetectable		 3elzA-2r94A:
17.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3EM3_B_478B200_2
(PROTEASE)		 2r94 2-KETO-3-DEOXY-(6-PH
OSPHO-)GLUCONATE
ALDOLASE
(Thermoproteus
tenax) 		5 / 10 LEU A 247
VAL A 297
ILE A 269
VAL A 251
ILE A 250
 None
 1.00A 3em3B-2r94A:
undetectable		 3em3B-2r94A:
15.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3EM6_A_017A200_2
(PROTEASE)		 2r94 2-KETO-3-DEOXY-(6-PH
OSPHO-)GLUCONATE
ALDOLASE
(Thermoproteus
tenax) 		6 / 12 LEU A 225
ASP A 236
VAL A 232
ILE A 237
VAL A 202
ILE A 228
 None
 1.37A 3em6B-2r94A:
undetectable		 3em6B-2r94A:
15.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3NNE_G_ACTG601_0
(CHOLINE OXIDASE)		 2r94 2-KETO-3-DEOXY-(6-PH
OSPHO-)GLUCONATE
ALDOLASE
(Thermoproteus
tenax) 		4 / 6 ALA A 218
ILE A  48
HIS A  44
VAL A 267
 None
 1.21A 3nneG-2r94A:
undetectable		 3nneG-2r94A:
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.
3NU5_B_478B401_1
(PROTEASE)		 2r94 2-KETO-3-DEOXY-(6-PH
OSPHO-)GLUCONATE
ALDOLASE
(Thermoproteus
tenax) 		6 / 12 LEU A 225
ASP A 236
VAL A 232
ILE A 237
VAL A 202
ILE A 228
 None
 1.37A 3nu5A-2r94A:
undetectable		 3nu5A-2r94A:
15.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4DQF_B_017B101_1
(ASPARTYL PROTEASE)		 2r94 2-KETO-3-DEOXY-(6-PH
OSPHO-)GLUCONATE
ALDOLASE
(Thermoproteus
tenax) 		6 / 12 LEU A 225
ASP A 236
VAL A 232
ILE A 237
VAL A 202
ILE A 228
 None
 1.35A 4dqfA-2r94A:
undetectable		 4dqfA-2r94A:
15.30
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.
4HAJ_A_DXCA75_0
(PPCA)		 2r94 2-KETO-3-DEOXY-(6-PH
OSPHO-)GLUCONATE
ALDOLASE
(Thermoproteus
tenax) 		4 / 7 LEU A 225
PHE A 206
MET A  21
GLY A 212
 None
 1.02A 4hajA-2r94A:
undetectable		 4hajA-2r94A:
11.91
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.
4JEC_B_478B401_1
(HIV-1 PROTEASE)		 2r94 2-KETO-3-DEOXY-(6-PH
OSPHO-)GLUCONATE
ALDOLASE
(Thermoproteus
tenax) 		6 / 12 LEU A 225
ASP A 236
VAL A 232
ILE A 237
VAL A 202
ILE A 228
 None
 1.42A 4jecA-2r94A:
undetectable		 4jecA-2r94A:
16.37
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.
4NKV_B_AERB601_1
(STEROID
17-ALPHA-HYDROXYLASE
/17,20 LYASE)		 2r94 2-KETO-3-DEOXY-(6-PH
OSPHO-)GLUCONATE
ALDOLASE
(Thermoproteus
tenax) 		5 / 12 ASN A 176
LEU A 210
ALA A 160
VAL A 194
VAL A 172
 None
 1.00A 4nkvB-2r94A:
undetectable		 4nkvB-2r94A:
20.80
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.
4X3U_B_SVRB102_1
(CHROMOBOX PROTEIN
HOMOLOG 7)		 2r94 2-KETO-3-DEOXY-(6-PH
OSPHO-)GLUCONATE
ALDOLASE
(Thermoproteus
tenax) 		3 / 3 LYS A 173
ARG A  86
VAL A  87
 PYR  A 999 (-1.5A)
None
None
 1.04A 4x3uA-2r94A:
undetectable
4x3uB-2r94A:
undetectable		 4x3uA-2r94A:
12.93
4x3uB-2r94A:
12.93
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.
5E3I_B_HISB502_0
(HISTIDINE--TRNA
LIGASE)		 2r94 2-KETO-3-DEOXY-(6-PH
OSPHO-)GLUCONATE
ALDOLASE
(Thermoproteus
tenax) 		5 / 11 THR A  61
ARG A 255
TYR A 150
GLY A 197
TYR A 148
 PYR  A 999 (-4.3A)
None
None
PYR  A 999 (-4.6A)
PYR  A 999 (-4.5A)
 1.31A 5e3iB-2r94A:
undetectable		 5e3iB-2r94A:
22.25
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.
5JW1_B_CELB602_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 2r94 2-KETO-3-DEOXY-(6-PH
OSPHO-)GLUCONATE
ALDOLASE
(Thermoproteus
tenax) 		5 / 12 LEU A  36
ALA A  84
GLY A  60
ALA A  59
LEU A  68
 None
None
PYR  A 999 (-3.0A)
None
None
 1.07A 5jw1B-2r94A:
0.5		 5jw1B-2r94A:
18.74
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.
5JWA_A_ACTA612_0
(NADH DEHYDROGENASE,
PUTATIVE)		 2r94 2-KETO-3-DEOXY-(6-PH
OSPHO-)GLUCONATE
ALDOLASE
(Thermoproteus
tenax) 		3 / 3 LYS A  21
ASP A  54
ARG A 193
 None
 0.97A 5jwaA-2r94A:
undetectable
5jwaH-2r94A:
undetectable		 5jwaA-2r94A:
18.29
5jwaH-2r94A:
18.29
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.
5KVA_A_SAMA301_0
(CAFFEOYL-COA
O-METHYLTRANSFERASE)		 2r94 2-KETO-3-DEOXY-(6-PH
OSPHO-)GLUCONATE
ALDOLASE
(Thermoproteus
tenax) 		5 / 12 GLU A 289
TYR A 283
ILE A 269
ALA A 296
ALA A 254
 None
 1.17A 5kvaA-2r94A:
undetectable		 5kvaA-2r94A:
22.71
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.
5KVA_B_SAMB301_0
(CAFFEOYL-COA
O-METHYLTRANSFERASE)		 2r94 2-KETO-3-DEOXY-(6-PH
OSPHO-)GLUCONATE
ALDOLASE
(Thermoproteus
tenax) 		5 / 12 GLU A 289
TYR A 283
ILE A 269
ALA A 296
ALA A 254
 None
 1.16A 5kvaB-2r94A:
undetectable		 5kvaB-2r94A:
22.71
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.
5LJE_A_RTLA201_0
(RETINOL-BINDING
PROTEIN 1)		 2r94 2-KETO-3-DEOXY-(6-PH
OSPHO-)GLUCONATE
ALDOLASE
(Thermoproteus
tenax) 		5 / 12 LEU A 293
ALA A 262
LEU A 224
ILE A 269
LEU A 246
 None
 1.12A 5ljeA-2r94A:
undetectable		 5ljeA-2r94A:
20.07
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.
5TIW_B_OAQB302_0
(SULFOTRANSFERASE)		 2r94 2-KETO-3-DEOXY-(6-PH
OSPHO-)GLUCONATE
ALDOLASE
(Thermoproteus
tenax) 		5 / 12 ASP A 248
LEU A 247
VAL A 202
SER A 217
THR A 182
 None
 1.17A 5tiwB-2r94A:
undetectable		 5tiwB-2r94A:
21.77
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.
5UUN_A_ACTA307_0
(GLUTATHIONE
S-TRANSFERASE-LIKE
PROTEIN)		 2r94 2-KETO-3-DEOXY-(6-PH
OSPHO-)GLUCONATE
ALDOLASE
(Thermoproteus
tenax) 		4 / 4 LEU A 247
LEU A 225
SER A 216
ALA A 218
 None
 0.93A 5uunA-2r94A:
undetectable		 5uunA-2r94A:
25.61
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.
5Y9Y_A_ACTA412_0
(UNCHARACTERIZED
PROTEIN KDOO)		 2r94 2-KETO-3-DEOXY-(6-PH
OSPHO-)GLUCONATE
ALDOLASE
(Thermoproteus
tenax) 		3 / 3 ARG A  86
PHE A 146
ARG A 193
 None
 1.15A 5y9yA-2r94A:
undetectable		 5y9yA-2r94A:
21.60
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.
6BRD_B_RFPB502_2
(RIFAMPIN
MONOOXYGENASE)		 2r94 2-KETO-3-DEOXY-(6-PH
OSPHO-)GLUCONATE
ALDOLASE
(Thermoproteus
tenax) 		4 / 6 GLN A  90
VAL A 214
LEU A 102
ARG A 109
 None
 1.18A 6brdB-2r94A:
undetectable		 6brdB-2r94A:
15.38