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5M2G

PCE reductive dehalogenase from S. multivorans in complex with 2,4,6-tribromophenol

Functional Information from GO Data
ChainGOidnamespacecontents
A0005737cellular_componentcytoplasm
A0005886cellular_componentplasma membrane
A0016020cellular_componentmembrane
A0016491molecular_functionoxidoreductase activity
A0046872molecular_functionmetal ion binding
A0051536molecular_functioniron-sulfur cluster binding
A0051539molecular_function4 iron, 4 sulfur cluster binding
B0005737cellular_componentcytoplasm
B0005886cellular_componentplasma membrane
B0016020cellular_componentmembrane
B0016491molecular_functionoxidoreductase activity
B0046872molecular_functionmetal ion binding
B0051536molecular_functioniron-sulfur cluster binding
B0051539molecular_function4 iron, 4 sulfur cluster binding
Functional Information from PDB Data
site_idAC1
Number of Residues6
Detailsbinding site for residue SF4 A 501
ChainResidue
AMET292
ACYS329
ACYS332
ALYS333
ACYS335
ACYS390

site_idAC2
Number of Residues9
Detailsbinding site for residue SF4 A 502
ChainResidue
AILE344
ACYS372
ACYS383
AGLY384
ACYS386
ABVQ503
ACYS339
APRO340
ASER341

site_idAC3
Number of Residues42
Detailsbinding site for residue BVQ A 503
ChainResidue
ATYR31
ATHR36
AALA37
APHE38
ATYR170
ATHR242
ATYR246
AMET249
AASN272
AGLY275
AGLN276
ASER277
AVAL278
AALA289
AMET292
AGLY293
AALA294
ACYS295
APRO302
AVAL304
AARG305
ALEU306
ALYS308
AHIS357
AASN358
AGLN359
ALYS362
AGLN364
ATYR369
ACYS372
ATRP376
ATYR382
AVAL387
ASF4502
ATBP510
AHOH604
AHOH615
AHOH714
AHOH732
AHOH741
AHOH812
AHOH841

site_idAC4
Number of Residues5
Detailsbinding site for residue BEN A 504
ChainResidue
ATHR39
APHE44
AGLU189
AILE399
ABEN511

site_idAC5
Number of Residues7
Detailsbinding site for residue GOL A 505
ChainResidue
APHE38
APHE44
ATRP56
AASN101
AGLU189
AHOH747
AHOH789

site_idAC6
Number of Residues6
Detailsbinding site for residue GOL A 506
ChainResidue
APHE110
AMET119
AHOH678
AHOH727
AHOH770
BPHE111

site_idAC7
Number of Residues5
Detailsbinding site for residue GOL A 507
ChainResidue
AGLU330
APRO348
AARG349
AHOH642
AHOH744

site_idAC8
Number of Residues6
Detailsbinding site for residue GOL A 508
ChainResidue
AARG349
ATHR350
AHOH680
AHOH712
AHOH797
BGLU172

site_idAC9
Number of Residues4
Detailsbinding site for residue GOL A 509
ChainResidue
AASP322
AGLY324
AHOH629
AHOH850

site_idAD1
Number of Residues12
Detailsbinding site for residue TBP A 510
ChainResidue
ABVQ503
AHOH604
AHOH789
APHE38
ATRP56
ATRP96
ATYR102
ATHR242
ATYR246
AASN272
ATRP376
ATYR382

site_idAD2
Number of Residues4
Detailsbinding site for residue BEN A 511
ChainResidue
AVAL34
ATHR39
AGLU189
ABEN504

site_idAD3
Number of Residues9
Detailsbinding site for residue SF4 B 501
ChainResidue
BARG291
BMET292
BPHE328
BCYS329
BCYS332
BLYS333
BCYS335
BCYS390
BPHE392

site_idAD4
Number of Residues8
Detailsbinding site for residue SF4 B 502
ChainResidue
BCYS339
BPRO340
BSER341
BCYS372
BCYS383
BGLY384
BCYS386
BBVQ503

site_idAD5
Number of Residues40
Detailsbinding site for residue BVQ B 503
ChainResidue
BTYR31
BTHR36
BALA37
BPHE38
BTYR170
BTHR242
BTYR246
BMET249
BASN272
BGLY275
BGLN276
BSER277
BVAL278
BALA289
BMET292
BGLY293
BALA294
BCYS295
BPRO302
BVAL304
BARG305
BLEU306
BLYS308
BHIS357
BASN358
BGLN359
BLYS362
BGLN364
BTYR369
BCYS372
BTRP376
BTYR382
BSF4502
BTBP506
BHOH604
BHOH614
BHOH668
BHOH681
BHOH686
BHOH764

site_idAD6
Number of Residues5
Detailsbinding site for residue GOL B 504
ChainResidue
BPHE38
BLEU186
BGLU189
BHOH603
BHOH662

site_idAD7
Number of Residues8
Detailsbinding site for residue GOL B 505
ChainResidue
APHE111
BPHE110
BLEU113
BMET119
BHOH631
BHOH640
BHOH672
BHOH692

site_idAD8
Number of Residues11
Detailsbinding site for residue TBP B 506
ChainResidue
BPHE38
BTRP56
BTYR102
BTHR242
BTYR246
BASN272
BTRP376
BTYR382
BBVQ503
BHOH603
BHOH604

Functional Information from PROSITE/UniProt
site_idPS00198
Number of Residues12
Details4FE4S_FER_1 4Fe-4S ferredoxin-type iron-sulfur binding region signature. CeTCKkCArECP
ChainResidueDetails
ACYS329-PRO340

Functional Information from SwissProt/UniProt
site_idSWS_FT_FI1
Number of Residues60
DetailsDomain: {"description":"4Fe-4S ferredoxin-type 1","evidences":[{"source":"PROSITE-ProRule","id":"PRU00711","evidenceCode":"ECO:0000255"}]}
ChainResidueDetails

site_idSWS_FT_FI2
Number of Residues19
DetailsDomain: {"description":"4Fe-4S ferredoxin-type 2","evidences":[{"source":"PROSITE-ProRule","id":"PRU00711","evidenceCode":"ECO:0000255"}]}
ChainResidueDetails

site_idSWS_FT_FI3
Number of Residues56
DetailsBinding site: {"evidences":[{"source":"PubMed","id":"28671181","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"29378885","evidenceCode":"ECO:0000269"},{"source":"PDB","id":"5M2G","evidenceCode":"ECO:0000312"},{"source":"PDB","id":"5M8U","evidenceCode":"ECO:0000312"},{"source":"PDB","id":"5M8W","evidenceCode":"ECO:0000312"},{"source":"PDB","id":"5MA2","evidenceCode":"ECO:0000312"},{"source":"PDB","id":"5OBP","evidenceCode":"ECO:0000312"}]}
ChainResidueDetails

238582

PDB entries from 2025-07-09

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