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5CS2

Crystal structure of Plasmodium falciparum diadenosine triphosphate hydrolase in complex with Cyclomarin A

Functional Information from GO Data
ChainGOidnamespacecontents
A0000166molecular_functionnucleotide binding
A0003824molecular_functioncatalytic activity
A0008270molecular_functionzinc ion binding
A0016787molecular_functionhydrolase activity
A0047710molecular_functionbis(5'-adenosyl)-triphosphatase activity
Functional Information from PDB Data
site_idAC1
Number of Residues3
Detailsbinding site for residue CL A 1000
ChainResidue
AGLY25
AILE26
AASP112

site_idAC2
Number of Residues22
Detailsbinding site for residues 54C B 1 and WVL B 7
ChainResidue
AGLY108
AGLY108
ATHR110
ATHR110
AARG121
AARG121
BWLU2
BWLU2
BALA3
BALA3
BWPA4
BWPA4
BVAL5
BVAL5
BMLE6
BMLE6
AGLN102
AGLN102
AGLU106
AGLU106
AALA107
AALA107

site_idAC3
Number of Residues20
Detailsbinding site for residues 54C B 1 and WLU B 2
ChainResidue
AGLN102
AGLN102
AGLU106
AGLU106
AALA107
AALA107
AGLY108
AGLY108
ATHR110
ATHR110
AARG121
AARG121
BALA3
BALA3
BWPA4
BWPA4
BVAL5
BVAL5
BWVL7
BWVL7

site_idAC4
Number of Residues10
Detailsbinding site for residues WLU B 2 and WPA B 4
ChainResidue
B54C1
B54C1
BALA3
BALA3
BVAL5
BVAL5
BMLE6
BMLE6
BWVL7
BWVL7

site_idAC5
Number of Residues14
Detailsbinding site for residues MLE B 6 and WVL B 7
ChainResidue
AHIS117
AHIS117
AARG121
AARG121
AHOH1123
AHOH1123
B54C1
B54C1
BALA3
BALA3
BWPA4
BWPA4
BVAL5
BVAL5

site_idAC6
Number of Residues14
Detailsbinding site for residues MLE B 6 and WVL B 7
ChainResidue
AHIS117
AHIS117
AARG121
AARG121
AHOH1123
AHOH1123
B54C1
B54C1
BALA3
BALA3
BWPA4
BWPA4
BVAL5
BVAL5

site_idAC7
Number of Residues14
Detailsbinding site for residues MLE B 6 and WVL B 7
ChainResidue
AHIS117
AHIS117
AARG121
AARG121
AHOH1123
AHOH1123
B54C1
B54C1
BALA3
BALA3
BWPA4
BWPA4
BVAL5
BVAL5

site_idAC8
Number of Residues14
Detailsbinding site for residues MLE B 6 and WVL B 7
ChainResidue
AARG121
AARG121
AHOH1123
AHOH1123
B54C1
B54C1
BALA3
BALA3
BWPA4
BWPA4
BVAL5
BVAL5
AHIS117
AHIS117

Functional Information from PROSITE/UniProt
site_idPS00892
Number of Residues19
DetailsHIT_1 HIT domain signature. QdgkeAgQtVdHVHIHIIP
ChainResidueDetails
AGLN102-PRO120

220113

PDB entries from 2024-05-22

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