SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4fwi'

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.
1KXH_A_ACRA598_1
(ALPHA-AMYLASE)		 4fwi ABC-TYPE
DIPEPTIDE/OLIGOPEPTI
DE/NICKEL TRANSPORT
SYSTEM, ATPASE
COMPONENT
(Caldanaerobacter
subterraneus) 		5 / 12 ALA B  23
GLY B  46
ALA B 226
ILE B 242
HIS B 248
 ATP  B 402 ( 4.0A)
ATP  B 402 (-3.0A)
None
None
SF4  B 401 (-3.7A)
 1.24A 1kxhA-4fwiB:
undetectable		 1kxhA-4fwiB:
20.95
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.
1MJQ_G_SAMG199_0
(METHIONINE REPRESSOR)		 4fwi ABC-TYPE
DIPEPTIDE/OLIGOPEPTI
DE/NICKEL TRANSPORT
SYSTEM, ATPASE
COMPONENT
(Caldanaerobacter
subterraneus) 		5 / 10 GLU B  52
ALA B  53
LEU B  58
PRO B  59
ALA B  12
 None
None
None
ATP  B 402 ( 4.9A)
None
 1.19A 1mjqG-4fwiB:
undetectable
1mjqH-4fwiB:
undetectable		 1mjqG-4fwiB:
16.30
1mjqH-4fwiB:
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.
1QHS_A_CLMA999_0
(PROTEIN
(CHLORAMPHENICOL
PHOSPHOTRANSFERASE))		 4fwi ABC-TYPE
DIPEPTIDE/OLIGOPEPTI
DE/NICKEL TRANSPORT
SYSTEM, ATPASE
COMPONENT
(Caldanaerobacter
subterraneus) 		5 / 12 ILE B 177
ILE B  51
ILE B  50
VAL B  69
LEU B  10
 None
 1.01A 1qhsA-4fwiB:
2.3		 1qhsA-4fwiB:
19.64
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.
1QHY_A_CLMA999_0
(CHLORAMPHENICOL
PHOSPHOTRANSFERASE)		 4fwi ABC-TYPE
DIPEPTIDE/OLIGOPEPTI
DE/NICKEL TRANSPORT
SYSTEM, ATPASE
COMPONENT
(Caldanaerobacter
subterraneus) 		5 / 12 ILE B 177
ILE B  51
ILE B  50
VAL B  69
LEU B  10
 None
 0.99A 1qhyA-4fwiB:
2.3		 1qhyA-4fwiB:
19.64
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.
1YAJ_B_BEZB12_0
(CES1 PROTEIN)		 4fwi ABC-TYPE
DIPEPTIDE/OLIGOPEPTI
DE/NICKEL TRANSPORT
SYSTEM, ATPASE
COMPONENT
(Caldanaerobacter
subterraneus) 		4 / 4 GLY B  41
SER B  45
VAL B 234
LEU B 254
 None
ATP  B 402 (-3.7A)
None
None
 0.89A 1yajB-4fwiB:
2.5		 1yajB-4fwiB:
21.68
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.
2AVD_B_SAMB601_1
(CATECHOL-O-METHYLTRA
NSFERASE)		 4fwi ABC-TYPE
DIPEPTIDE/OLIGOPEPTI
DE/NICKEL TRANSPORT
SYSTEM, ATPASE
COMPONENT
(Caldanaerobacter
subterraneus) 		3 / 3 SER B 257
GLU B  42
ASP B 274
 None
 0.74A 2avdB-4fwiB:
undetectable		 2avdB-4fwiB:
22.09
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.
2BXE_B_1FLB2002_1
(SERUM ALBUMIN)		 4fwi ABC-TYPE
DIPEPTIDE/OLIGOPEPTI
DE/NICKEL TRANSPORT
SYSTEM, ATPASE
COMPONENT
(Caldanaerobacter
subterraneus) 		5 / 11 ALA B 133
LEU B 137
ALA B 166
SER B 150
VAL B 147
 None
 1.14A 2bxeB-4fwiB:
undetectable		 2bxeB-4fwiB:
21.04
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.
2QD5_B_CHDB1103_0
(FERROCHELATASE)		 4fwi ABC-TYPE
DIPEPTIDE/OLIGOPEPTI
DE/NICKEL TRANSPORT
SYSTEM, ATPASE
COMPONENT
(Caldanaerobacter
subterraneus) 		4 / 8 LEU B 278
ARG B  11
PRO B 289
GLY B 284
 ATP  B 402 ( 4.9A)
None
None
None
 1.07A 2qd5B-4fwiB:
undetectable		 2qd5B-4fwiB:
24.19
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.
2V0M_D_KLND1499_1
(CYTOCHROME P450 3A4)		 4fwi ABC-TYPE
DIPEPTIDE/OLIGOPEPTI
DE/NICKEL TRANSPORT
SYSTEM, ATPASE
COMPONENT
(Caldanaerobacter
subterraneus) 		4 / 5 PHE B 243
PHE B 210
SER B  35
ILE B  31
 None
 1.36A 2v0mD-4fwiB:
undetectable		 2v0mD-4fwiB:
21.53
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.
2YGQ_A_PCFA1275_0
(WNT INHIBITORY
FACTOR 1)		 4fwi ABC-TYPE
DIPEPTIDE/OLIGOPEPTI
DE/NICKEL TRANSPORT
SYSTEM, ATPASE
COMPONENT
(Caldanaerobacter
subterraneus) 		5 / 12 ILE B 255
ILE B 242
ILE B 271
PRO B 270
VAL B 314
 None
 1.06A 2ygqA-4fwiB:
undetectable		 2ygqA-4fwiB:
21.99
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_CHDA151_0
(ILEAL BILE
ACID-BINDING PROTEIN)		 4fwi ABC-TYPE
DIPEPTIDE/OLIGOPEPTI
DE/NICKEL TRANSPORT
SYSTEM, ATPASE
COMPONENT
(Caldanaerobacter
subterraneus) 		4 / 7 ILE B  51
GLY B  46
VAL B   7
LEU B  58
 None
ATP  B 402 (-3.0A)
None
None
 0.92A 3elzA-4fwiB:
undetectable		 3elzA-4fwiB:
18.31
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_CHDA151_0
(ILEAL BILE
ACID-BINDING PROTEIN)		 4fwi ABC-TYPE
DIPEPTIDE/OLIGOPEPTI
DE/NICKEL TRANSPORT
SYSTEM, ATPASE
COMPONENT
(Caldanaerobacter
subterraneus) 		4 / 7 ILE B 193
GLY B 157
VAL B  95
LEU B 142
 None
 0.68A 3elzA-4fwiB:
undetectable		 3elzA-4fwiB:
18.31
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.
3HCR_A_CHDA424_0
(FERROCHELATASE,
MITOCHONDRIAL)		 4fwi ABC-TYPE
DIPEPTIDE/OLIGOPEPTI
DE/NICKEL TRANSPORT
SYSTEM, ATPASE
COMPONENT
(Caldanaerobacter
subterraneus) 		4 / 8 LEU B 278
ARG B  11
PRO B 289
GLY B 284
 ATP  B 402 ( 4.9A)
None
None
None
 1.09A 3hcrA-4fwiB:
undetectable		 3hcrA-4fwiB:
24.19
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.
3LN1_D_CELD682_2
(PROSTAGLANDIN G/H
SYNTHASE 2)		 4fwi ABC-TYPE
DIPEPTIDE/OLIGOPEPTI
DE/NICKEL TRANSPORT
SYSTEM, ATPASE
COMPONENT
(Caldanaerobacter
subterraneus) 		4 / 5 ARG B 307
LEU B 233
ARG B   6
ILE B   5
 None
 1.27A 3ln1D-4fwiB:
undetectable		 3ln1D-4fwiB:
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.
4F4D_B_CHDB505_0
(FERROCHELATASE,
MITOCHONDRIAL)		 4fwi ABC-TYPE
DIPEPTIDE/OLIGOPEPTI
DE/NICKEL TRANSPORT
SYSTEM, ATPASE
COMPONENT
(Caldanaerobacter
subterraneus) 		5 / 12 MET B 139
LEU B 197
LEU B 200
ILE B 193
VAL B  95
 None
 1.18A 4f4dB-4fwiB:
undetectable		 4f4dB-4fwiB:
24.19
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.
4F8Y_B_VK3B202_1
(NADPH QUINONE
OXIDOREDUCTASE)		 4fwi ABC-TYPE
DIPEPTIDE/OLIGOPEPTI
DE/NICKEL TRANSPORT
SYSTEM, ATPASE
COMPONENT
(Caldanaerobacter
subterraneus) 		4 / 6 ASN B 245
ARG B 252
TYR B 319
LEU B 308
 None
 1.37A 4f8yA-4fwiB:
undetectable
4f8yB-4fwiB:
undetectable		 4f8yA-4fwiB:
22.75
4f8yB-4fwiB:
22.75
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.
4RZV_A_032A801_1
(SERINE/THREONINE-PRO
TEIN KINASE B-RAF)		 4fwi ABC-TYPE
DIPEPTIDE/OLIGOPEPTI
DE/NICKEL TRANSPORT
SYSTEM, ATPASE
COMPONENT
(Caldanaerobacter
subterraneus) 		5 / 12 ALA B  24
LEU B  58
THR B  49
SER B  66
GLY B  62
 None
None
ATP  B 402 (-3.4A)
None
None
 0.98A 4rzvA-4fwiB:
undetectable		 4rzvA-4fwiB:
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.
4WG0_C_CHDC102_0
(NUCLEAR RECEPTOR
COACTIVATOR 2)		 4fwi ABC-TYPE
DIPEPTIDE/OLIGOPEPTI
DE/NICKEL TRANSPORT
SYSTEM, ATPASE
COMPONENT
(Caldanaerobacter
subterraneus) 		4 / 7 GLU B 199
LYS B 198
LEU B 197
LEU B 221
 None
 0.77A 4wg0B-4fwiB:
undetectable
4wg0C-4fwiB:
undetectable		 4wg0B-4fwiB:
4.15
4wg0C-4fwiB:
4.15
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.
4WG0_L_CHDL103_0
(NUCLEAR RECEPTOR
COACTIVATOR 2)		 4fwi ABC-TYPE
DIPEPTIDE/OLIGOPEPTI
DE/NICKEL TRANSPORT
SYSTEM, ATPASE
COMPONENT
(Caldanaerobacter
subterraneus) 		4 / 7 LEU B 221
GLU B 199
LYS B 198
LEU B 197
 None
 0.81A 4wg0L-4fwiB:
undetectable
4wg0M-4fwiB:
undetectable		 4wg0L-4fwiB:
4.15
4wg0M-4fwiB:
4.15
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.
5O96_G_SAMG501_0
(RIBOSOMAL RNA SMALL
SUBUNIT
METHYLTRANSFERASE E)		 4fwi ABC-TYPE
DIPEPTIDE/OLIGOPEPTI
DE/NICKEL TRANSPORT
SYSTEM, ATPASE
COMPONENT
(Caldanaerobacter
subterraneus) 		6 / 11 LEU B  10
GLY B 231
VAL B  13
THR B  49
GLU B  52
ALA B  53
 None
None
None
ATP  B 402 (-3.4A)
None
None
 1.25A 5o96G-4fwiB:
undetectable		 5o96G-4fwiB:
21.93