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4BFZ

Crystal structure of Mycobacterium tuberculosis PanK in complex with a biaryl inhibitory compound (2b) and phosphate

Functional Information from GO Data
ChainGOidnamespacecontents
A0004594molecular_functionpantothenate kinase activity
A0005515molecular_functionprotein binding
A0005524molecular_functionATP binding
A0005737cellular_componentcytoplasm
A0005886cellular_componentplasma membrane
A0015937biological_processcoenzyme A biosynthetic process
A0016301molecular_functionkinase activity
B0004594molecular_functionpantothenate kinase activity
B0005515molecular_functionprotein binding
B0005524molecular_functionATP binding
B0005737cellular_componentcytoplasm
B0005886cellular_componentplasma membrane
B0015937biological_processcoenzyme A biosynthetic process
B0016301molecular_functionkinase activity
Functional Information from PDB Data
site_idAC1
Number of Residues9
DetailsBINDING SITE FOR RESIDUE PO4 A 401
ChainResidue
ASER98
AALA100
AVAL101
AGLY102
ALYS103
ASER104
AARG238
AHOH2048
AHOH2049

site_idAC2
Number of Residues18
DetailsBINDING SITE FOR RESIDUE ZVZ A 501
ChainResidue
AASP129
AMET144
AHIS145
ALYS147
AGLY148
ATYR182
ATYR235
APHE239
AMET242
APHE247
APHE254
AILE276
AASN277
AHOH2090
AHOH2118
AHOH2119
BGLU271
BARG274

site_idAC3
Number of Residues9
DetailsBINDING SITE FOR RESIDUE PO4 B 401
ChainResidue
BSER98
BALA100
BVAL101
BGLY102
BLYS103
BSER104
BARG238
BHOH2008
BHOH2036

site_idAC4
Number of Residues16
DetailsBINDING SITE FOR RESIDUE ZVZ B 501
ChainResidue
AGLU271
AARG274
BASP129
BMET144
BHIS145
BLYS147
BTYR182
BTYR235
BPHE239
BMET242
BPHE247
BPHE254
BILE276
BASN277
BHOH2073
BHOH2092

Functional Information from SwissProt/UniProt
site_idSWS_FT_FI1
Number of Residues2
DetailsBINDING: BINDING => ECO:0000255
ChainResidueDetails
AGLY97
BGLY97

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PDB entries from 2024-07-24

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