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5UU7

Tetragonal thermolysin (295 K) in the presence of 50% mpd

Functional Information from GO Data
ChainGOidnamespacecontents
A0004222molecular_functionmetalloendopeptidase activity
A0006508biological_processproteolysis
Functional Information from PDB Data
site_idAC1
Number of Residues7
Detailsbinding site for residue CA A 401
ChainResidue
AASP138
AGLU177
AASP185
AGLU187
AGLU190
AZN402
AHOH584

site_idAC2
Number of Residues7
Detailsbinding site for residue ZN A 402
ChainResidue
AASP185
AGLU190
ACA401
AHOH525
AHOH538
AGLU177
AASN183

site_idAC3
Number of Residues6
Detailsbinding site for residue CA A 403
ChainResidue
AASP57
AASP59
AGLN61
AHOH522
AHOH563
AHOH718

site_idAC4
Number of Residues6
Detailsbinding site for residue CA A 404
ChainResidue
ATYR193
ATHR194
AILE197
AASP200
AHOH559
AHOH686

site_idAC5
Number of Residues5
Detailsbinding site for residue ZN A 405
ChainResidue
AHIS142
AHIS146
AGLU166
AZN406
AHOH620

site_idAC6
Number of Residues6
Detailsbinding site for residue ZN A 406
ChainResidue
AGLU143
AZN405
AMRD416
AHOH535
AHOH620
AHOH633

site_idAC7
Number of Residues4
Detailsbinding site for residue ZN A 407
ChainResidue
AASP226
AHIS231
AHOH721
AHOH736

site_idAC8
Number of Residues5
Detailsbinding site for residue ZN A 408
ChainResidue
ALYS239
AZN409
ACL411
ACL412
AHOH636

site_idAC9
Number of Residues5
Detailsbinding site for residue ZN A 409
ChainResidue
AHIS250
AZN408
ACL413
ACL414
AHOH636

site_idAD1
Number of Residues6
Detailsbinding site for residue ZN A 410
ChainResidue
AASP213
AHOH515
AHOH604
AHOH614
AHOH666
AHOH744

site_idAD2
Number of Residues4
Detailsbinding site for residue CL A 411
ChainResidue
ALYS239
AZN408
ACL412
AHOH636

site_idAD3
Number of Residues3
Detailsbinding site for residue CL A 412
ChainResidue
ALYS239
AZN408
ACL411

site_idAD4
Number of Residues4
Detailsbinding site for residue CL A 413
ChainResidue
AARG47
AASP215
AHIS250
AZN409

site_idAD5
Number of Residues5
Detailsbinding site for residue CL A 414
ChainResidue
ALYS45
AARG47
AHIS250
ATYR251
AZN409

site_idAD6
Number of Residues3
Detailsbinding site for residue MRD A 415
ChainResidue
ATYR274
AGLN283
AALA286

site_idAD7
Number of Residues9
Detailsbinding site for residue MRD A 416
ChainResidue
AASN112
AALA113
ALEU133
AHIS142
AGLU143
ALEU202
AARG203
AZN406
AHOH625

site_idAD8
Number of Residues7
Detailsbinding site for residue MPD A 417
ChainResidue
ASER25
ATYR29
AGLY212
AASP213
AHOH548
AHOH604
AHOH666

site_idAD9
Number of Residues2
Detailsbinding site for residue DMS A 418
ChainResidue
AHIS216
AHOH747

Functional Information from PROSITE/UniProt
site_idPS00142
Number of Residues10
DetailsZINC_PROTEASE Neutral zinc metallopeptidases, zinc-binding region signature. VVAHELTHAV
ChainResidueDetails
AVAL139-VAL148

Functional Information from SwissProt/UniProt
site_idSWS_FT_FI1
Number of Residues1
DetailsACT_SITE: ACT_SITE => ECO:0000255|PROSITE-ProRule:PRU10095, ECO:0000269|PubMed:4808703
ChainResidueDetails
AGLU143

site_idSWS_FT_FI2
Number of Residues1
DetailsACT_SITE: Proton donor => ECO:0000255|PROSITE-ProRule:PRU10095, ECO:0000269|PubMed:4808703
ChainResidueDetails
AHIS231

site_idSWS_FT_FI3
Number of Residues16
DetailsBINDING:
ChainResidueDetails
AASP57
AASP185
AGLU187
AGLU190
ATYR193
ATHR194
AILE197
AASP200
AASP59
AGLN61
AASP138
AHIS142
AHIS146
AGLU166
AGLU177
AASN183

Catalytic Information from CSA
site_idMCSA1
Number of Residues7
DetailsM-CSA 176
ChainResidueDetails
AHIS142metal ligand
AGLU143electrostatic stabiliser, metal ligand
AHIS146metal ligand
ATYR157electrostatic stabiliser, hydrogen bond donor, steric role
AGLU166metal ligand
AASP226activator, electrostatic stabiliser, hydrogen bond acceptor
AHIS231hydrogen bond acceptor, hydrogen bond donor, proton acceptor, proton donor

222624

PDB entries from 2024-07-17

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