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2Y4O

Crystal Structure of PaaK2 in complex with phenylacetyl adenylate

Functional Information from GO Data
ChainGOidnamespacecontents
A0000166molecular_functionnucleotide binding
A0010124biological_processphenylacetate catabolic process
A0016874molecular_functionligase activity
A0046872molecular_functionmetal ion binding
A0047475molecular_functionphenylacetate-CoA ligase activity
B0000166molecular_functionnucleotide binding
B0010124biological_processphenylacetate catabolic process
B0016874molecular_functionligase activity
B0046872molecular_functionmetal ion binding
B0047475molecular_functionphenylacetate-CoA ligase activity
Functional Information from PDB Data
site_idAC1
Number of Residues23
DetailsBINDING SITE FOR RESIDUE DLL B 1438
ChainResidue
BPHE140
BTYR241
BGLY242
BLEU243
BSER244
BPRO249
BASP309
BARG330
BILE336
BASN341
BK1446
BPHE145
BHOH2329
BHOH2471
BHOH2472
BHOH2473
BTHR146
BGLY147
BALA218
BGLU219
BPRO220
BASP239
BILE240

site_idAC2
Number of Residues4
DetailsBINDING SITE FOR RESIDUE PEG B 1439
ChainResidue
AARG157
AHOH2192
BHOH2474
BHOH2475

site_idAC3
Number of Residues6
DetailsBINDING SITE FOR RESIDUE PEG B 1440
ChainResidue
AARG45
AASP49
BTYR38
BARG45
BASP49
BHOH2476

site_idAC4
Number of Residues3
DetailsBINDING SITE FOR RESIDUE PEG B 1441
ChainResidue
BALA65
BPHE67
BPRO68

site_idAC5
Number of Residues3
DetailsBINDING SITE FOR RESIDUE PEG B 1442
ChainResidue
BHIS43
BARG46
BASN78

site_idAC6
Number of Residues9
DetailsBINDING SITE FOR RESIDUE PEG B 1443
ChainResidue
BTRP221
BTHR222
BGLN223
BARG226
BASP239
BLYS326
BHOH2315
BHOH2330
BHOH2395

site_idAC7
Number of Residues6
DetailsBINDING SITE FOR RESIDUE BME B 1444
ChainResidue
BGLN23
BGLN26
BGLU266
BARG322
BHOH2083
BHOH2477

site_idAC8
Number of Residues6
DetailsBINDING SITE FOR RESIDUE MG A 1439
ChainResidue
AALA207
ASER209
ALEU211
AVAL233
AHOH2244
AHOH2264

site_idAC9
Number of Residues6
DetailsBINDING SITE FOR RESIDUE MG B 1445
ChainResidue
BALA207
BSER209
BLEU211
BVAL233
BHOH2303
BHOH2306

site_idBC1
Number of Residues4
DetailsBINDING SITE FOR RESIDUE K A 1440
ChainResidue
AALA218
AGLY339
AASN341
ADLL1441

site_idBC2
Number of Residues4
DetailsBINDING SITE FOR RESIDUE K B 1446
ChainResidue
BALA218
BGLY339
BASN341
BDLL1438

site_idBC3
Number of Residues23
DetailsBINDING SITE FOR RESIDUE DLL A 1441
ChainResidue
APHE140
APHE145
ATHR146
AGLY147
AALA218
AGLU219
APRO220
AASP239
AILE240
ATYR241
AGLY242
ALEU243
ASER244
AASP309
AARG330
AILE336
AASN341
AK1440
AHOH2139
AHOH2380
AHOH2381
AHOH2382
AHOH2383

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PDB entries from 2024-11-13

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