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6MDC

Non-receptor Protein Tyrosine Phosphatase SHP2 in Complex with Allosteric Inhibitor Pyrazolo-pyrimidinone 1 SHP389

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 Residues13
Detailsbinding site for residue JEA A 601
ChainResidue
ATHR108
ALEU254
AGLN257
APRO491
AHOH868
AGLU110
AARG111
APHE113
ALEU216
ATHR219
AGLU249
AGLU250
ATHR253

site_idAC2
Number of Residues6
Detailsbinding site for residue PO4 A 602
ChainResidue
AGLU195
ALYS198
AGLN257
ALYS260
AHOH797
AHOH799

site_idAC3
Number of Residues5
Detailsbinding site for residue PO4 A 603
ChainResidue
AARG32
ASER34
ALYS35
ASER36
ATHR42

site_idAC4
Number of Residues2
Detailsbinding site for residue PO4 A 604
ChainResidue
AARG138
ASER140

site_idAC5
Number of Residues13
Detailsbinding site for residue JEA B 601
ChainResidue
BTHR108
BGLU110
BARG111
BPHE113
BLEU216
BTHR218
BTHR219
BGLU249
BGLU250
BTHR253
BLEU254
BGLN257
BPRO491

site_idAC6
Number of Residues6
Detailsbinding site for residue PO4 B 602
ChainResidue
BARG32
BSER34
BLYS35
BSER36
BTHR42
BHOH816

site_idAC7
Number of Residues4
Detailsbinding site for residue PO4 B 603
ChainResidue
BGLY119
BARG138
BSER140
BSER142

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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