Target Binding Site Detail

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Target General Information
Ligand General Information
Drug Binding Sites of Target
References
Target General Information  Top
Target ID T88752 Target Info
Target Name Ras-related C3 botulinum toxin substrate 1 (RAC1)
Synonyms Cell migration-inducing gene5 protein
Target Type Literature-reported Target
Gene Name RAC1
Biochemical Class Small GTPase
UniProt ID
RAC1_HUMAN
Ligand General Information  Top
Ligand Name Aluminum fluoride Ligand Info
Canonical SMILES F[Al](F)F
InChI 1S/Al.3FH/h;3*1H/q+3;;;/p-3
InChIKey KLZUFWVZNOTSEM-UHFFFAOYSA-K
PubChem Compound ID 2124
Drug Binding Sites of Target  Top
PDB ID: 1G4U      CRYSTAL STRUCTURE OF THE SALMONELLA TYROSINE PHOSPHATASE AND GTPASE ACTIVATING PROTEIN SPTP BOUND TO RAC1
Method X-ray diffraction Resolution 2.30 Å Mutation Yes [1]
PDB Sequence
MQAIKCVVVG
10
DGAVGKTCLL
20
ISYTTNAFPG
30
EYIPTVFDNY
40
SANVMVDGKP
50

VNLGLWDTAG
60
QEDYDRLRPL
70
SYPQTDVSLI
80
CFSLVSPASF
90
ENVRAKWYPE
100

VRHHCPNTPI
110
ILVGTKLDLR
120
DDKDTIEKLK
130
EKKLTPITYP
140
QGLAMAKEIG
150

AVKYLECSAL
160
TQRGLKTVFD
170
EAIRAVLCPP
180
Residue
Distance (Å)
GLY10
4.150
ASP11
3.997
GLY12
3.309
ALA13
3.473
LYS16
2.510
THR17
4.852
Residue
Distance (Å)
PRO34
4.994
THR35
3.695
THR58
4.081
ALA59
3.935
GLY60
2.882
GLN61
2.966
PDB ID: 1HE1      Crystal structure of the complex between the GAP domain of the Pseudomonas aeruginosa ExoS toxin and human Rac
Method X-ray diffraction Resolution 2.00 Å Mutation No [2]
PDB Sequence
PQAIKCVVVG
10
DGAVGKTCLL
20
ISYTTNAFPG
30
EYIPTVFDNY
40
SANVMVDGKP
50

VNLGLWDTAG
60
QEDYDRLRPL
70
SYPQTDVFLI
80
CFSLVSPASF
90
ENVRAKWYPE
100

VRHHCPNTPI
110
ILVGTKLDLR
120
DDKDTIEKLK
130
EKKLTPITYP
140
QGLAMAKEIG
150

AVKYLECSAL
160
TQRGLKTVFD
170
EAIRAV
Residue
Distance (Å)
GLY10
4.301
ASP11
4.075
GLY12
3.305
ALA13
3.588
LYS16
2.499
THR17
3.995
TYR32
4.723
Residue
Distance (Å)
ILE33
4.921
PRO34
4.434
THR35
2.900
THR58
3.648
ALA59
3.676
GLY60
2.686
GLN61
2.735
References  Top
REF 1 Modulation of host signaling by a bacterial mimic: structure of the Salmonella effector SptP bound to Rac1. Mol Cell. 2000 Dec;6(6):1449-60.
REF 2 How the Pseudomonas aeruginosa ExoS toxin downregulates Rac. Nat Struct Biol. 2001 Jan;8(1):23-6.

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