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4HUT

Structure of ATP:co(I)rrinoid adenosyltransferase (CobA) from Salmonella enterica in complex with four and five-coordinate cob(II)alamin and ATP

Functional Information from GO Data
ChainGOidnamespacecontents
A0005524molecular_functionATP binding
A0005737cellular_componentcytoplasm
A0006779biological_processporphyrin-containing compound biosynthetic process
A0008817molecular_functioncorrinoid adenosyltransferase activity
A0009236biological_processcobalamin biosynthetic process
A0016740molecular_functiontransferase activity
B0005524molecular_functionATP binding
B0005737cellular_componentcytoplasm
B0006779biological_processporphyrin-containing compound biosynthetic process
B0008817molecular_functioncorrinoid adenosyltransferase activity
B0009236biological_processcobalamin biosynthetic process
B0016740molecular_functiontransferase activity
Functional Information from PDB Data
site_idAC1
Number of Residues5
DetailsBINDING SITE FOR RESIDUE MG A 201
ChainResidue
ATHR42
AGLU128
AATP202
AHOH301
AHOH302

site_idAC2
Number of Residues22
DetailsBINDING SITE FOR RESIDUE ATP A 202
ChainResidue
ALYS41
ATHR42
ATHR43
AGLU128
AARG161
AHIS182
APHE184
AASP195
AMG201
AB12203
AHOH301
AHOH302
AHOH320
AHOH359
AHOH363
AHOH367
AHOH454
BARG51
AASN37
AGLY38
ALYS39
AGLY40

site_idAC3
Number of Residues19
DetailsBINDING SITE FOR RESIDUE B12 A 203
ChainResidue
AILE65
ATHR68
ATRP69
ATRP93
AGLU128
ATYR131
ATYR135
AARG161
APHE184
AALA190
AASP195
ATYR196
AATP202
AHOH356
AHOH363
AHOH369
AHOH390
AHOH449
AHOH462

site_idAC4
Number of Residues7
DetailsBINDING SITE FOR RESIDUE EDO A 204
ChainResidue
ALEU147
AASN148
AARG150
AHOH335
AHOH349
AHOH383
AHOH437

site_idAC5
Number of Residues4
DetailsBINDING SITE FOR RESIDUE EDO A 205
ChainResidue
AVAL53
AGLN96
AHOH472
BASN75

site_idAC6
Number of Residues6
DetailsBINDING SITE FOR RESIDUE MG B 201
ChainResidue
BTHR42
BLYS66
BGLU128
BATP202
BHOH301
BHOH303

site_idAC7
Number of Residues20
DetailsBINDING SITE FOR RESIDUE ATP B 202
ChainResidue
AARG51
BASN37
BGLY38
BLYS39
BGLY40
BLYS41
BTHR42
BTHR43
BGLU128
BARG161
BHIS182
BPHE184
BASP195
BMG201
BB12203
BHOH301
BHOH302
BHOH303
BHOH337
BHOH345

site_idAC8
Number of Residues31
DetailsBINDING SITE FOR RESIDUE B12 B 203
ChainResidue
BTYR135
BARG161
BPHE184
BALA190
BASP195
BTYR196
BATP202
BHOH305
BHOH316
BHOH342
BHOH352
BHOH364
BHOH411
BHOH417
BHOH418
AARG20
AVAL21
AARG51
AHOH388
AHOH419
BILE65
BLYS66
BGLY67
BTHR68
BTRP69
BGLY90
BPHE91
BTHR92
BTRP93
BGLU128
BTYR131

Functional Information from SwissProt/UniProt
site_idSWS_FT_FI1
Number of Residues2
DetailsBINDING: BINDING => ECO:0000250
ChainResidueDetails
AGLY36
BGLY36

Catalytic Information from CSA
site_idMCSA1
Number of Residues9
DetailsM-CSA 853
ChainResidueDetails
AASN37electrostatic stabiliser
ALYS39electrostatic stabiliser
ALYS41electrostatic stabiliser
ATHR42electrostatic stabiliser, metal ligand
ATHR43electrostatic stabiliser
AARG51electrostatic stabiliser
APHE91electrostatic stabiliser
ATRP93electrostatic stabiliser
AGLU128metal ligand

site_idMCSA2
Number of Residues9
DetailsM-CSA 853
ChainResidueDetails
BASN37electrostatic stabiliser
BLYS39electrostatic stabiliser
BLYS41electrostatic stabiliser
BTHR42electrostatic stabiliser, metal ligand
BTHR43electrostatic stabiliser
BARG51electrostatic stabiliser
BPHE91electrostatic stabiliser
BTRP93electrostatic stabiliser
BGLU128metal ligand

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PDB entries from 2024-07-10

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