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2CZ7

Fe-type NHase photo-activated for 75min at 105K

Functional Information from GO Data
ChainGOidnamespacecontents
A0003824molecular_functioncatalytic activity
A0016829molecular_functionlyase activity
A0018822molecular_functionnitrile hydratase activity
A0046872molecular_functionmetal ion binding
A0046914molecular_functiontransition metal ion binding
A0080109molecular_functionindole-3-acetonitrile nitrile hydratase activity
B0016829molecular_functionlyase activity
B0018822molecular_functionnitrile hydratase activity
B0046914molecular_functiontransition metal ion binding
B0080109molecular_functionindole-3-acetonitrile nitrile hydratase activity
Functional Information from PDB Data
site_idAC1
Number of Residues5
DetailsBINDING SITE FOR RESIDUE FE A 300
ChainResidue
ACYS109
ACSD112
ASER113
ACSO114
ANO301

site_idAC2
Number of Residues7
DetailsBINDING SITE FOR RESIDUE MG B 1302
ChainResidue
BHOH1791
BHOH1791
BHOH1843
BHOH1635
BHOH1639
BHOH1717
BHOH1733

site_idAC3
Number of Residues6
DetailsBINDING SITE FOR RESIDUE MG B 1619
ChainResidue
AHOH357
AHOH473
AHOH499
BHOH1773
BHOH1920
BHOH1935

site_idAC4
Number of Residues4
DetailsBINDING SITE FOR RESIDUE NO A 301
ChainResidue
ACSD112
ASER113
ACSO114
AFE300

Functional Information from SwissProt/UniProt
site_idSWS_FT_FI1
Number of Residues4
DetailsBINDING: BINDING => ECO:0000269|PubMed:9586994, ECO:0007744|PDB:2AHJ
ChainResidueDetails
ASER110
ASER113
ACSO114
ATHR115

site_idSWS_FT_FI2
Number of Residues1
DetailsMOD_RES: Cysteine sulfinic acid (-SO2H) => ECO:0000269|PubMed:9368004, ECO:0000269|PubMed:9586994
ChainResidueDetails
ASER113

site_idSWS_FT_FI3
Number of Residues1
DetailsMOD_RES: Cysteine sulfenic acid (-SOH) => ECO:0000269|PubMed:9586994
ChainResidueDetails
ATHR115

Catalytic Information from CSA
site_idCSA1
Number of Residues1
DetailsAnnotated By Reference To The Literature 1ahj
ChainResidueDetails
BARG56

site_idMCSA1
Number of Residues3
DetailsM-CSA 57
ChainResidueDetails
BARG56electrostatic stabiliser, proton acceptor, proton donor
BTYR72proton acceptor, proton donor
BTYR76increase acidity, increase basicity
ATHR115electrofuge, metal ligand, nucleophile, proton acceptor, proton donor

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PDB entries from 2024-07-24

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