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6MDD

Non-receptor Protein Tyrosine Phosphatase SHP2 in Complex with Allosteric Inhibitor Imidazo-pyridine 24

Functional Information from GO Data
ChainGOidnamespacecontents
A0004725molecular_functionprotein tyrosine phosphatase activity
A0006470biological_processprotein dephosphorylation
A0016311biological_processdephosphorylation
B0004725molecular_functionprotein tyrosine phosphatase activity
B0006470biological_processprotein dephosphorylation
B0016311biological_processdephosphorylation
Functional Information from PDB Data
site_idAC1
Number of Residues11
Detailsbinding site for residue JE7 A 601
ChainResidue
AARG111
AGLN495
AHOH772
ATHR218
ATHR219
AGLU250
ATHR253
ALEU254
AGLN257
APRO491
ALYS492

site_idAC2
Number of Residues5
Detailsbinding site for residue PO4 A 602
ChainResidue
AARG32
ASER34
ALYS35
ASER36
ATHR42

site_idAC3
Number of Residues11
Detailsbinding site for residue JE7 B 601
ChainResidue
BARG111
BTHR218
BTHR219
BGLU250
BTHR253
BGLN257
BPRO491
BLYS492
BGLN495
BHOH762
BHOH789

site_idAC4
Number of Residues6
Detailsbinding site for residue PO4 B 602
ChainResidue
BARG32
BSER34
BLYS35
BSER36
BTHR42
BHOH724

Functional Information from PROSITE/UniProt
site_idPS00383
Number of Residues11
DetailsTYR_PHOSPHATASE_1 Tyrosine specific protein phosphatases active site. VHCsaGigRTG
ChainResidueDetails
AVAL457-GLY467

Functional Information from SwissProt/UniProt
site_idSWS_FT_FI1
Number of Residues2
DetailsACT_SITE: Phosphocysteine intermediate
ChainResidueDetails
ACYS459
BCYS459

site_idSWS_FT_FI2
Number of Residues6
DetailsBINDING: BINDING => ECO:0000250
ChainResidueDetails
AASP425
ACYS459
AGLN506
BASP425
BCYS459
BGLN506

site_idSWS_FT_FI3
Number of Residues2
DetailsMOD_RES: N-acetylthreonine => ECO:0007744|PubMed:19413330
ChainResidueDetails
ATHR2
BTHR2

site_idSWS_FT_FI4
Number of Residues2
DetailsMOD_RES: Phosphotyrosine => ECO:0007744|PubMed:19690332
ChainResidueDetails
ATYR62
BTYR62

site_idSWS_FT_FI5
Number of Residues2
DetailsMOD_RES: Phosphotyrosine => ECO:0000250|UniProtKB:P35235
ChainResidueDetails
ATYR66
BTYR66

218853

PDB entries from 2024-04-24

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