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4R76

Structure of the m17 leucyl aminopeptidase from malaria complexed with a hydroxamic acid-based inhibitor

Functional Information from GO Data
ChainGOidnamespacecontents
A0005737cellular_componentcytoplasm
A0006508biological_processproteolysis
A0019538biological_processprotein metabolic process
A0030145molecular_functionmanganese ion binding
A0046872molecular_functionmetal ion binding
A0070006molecular_functionmetalloaminopeptidase activity
B0005737cellular_componentcytoplasm
B0006508biological_processproteolysis
B0019538biological_processprotein metabolic process
B0030145molecular_functionmanganese ion binding
B0046872molecular_functionmetal ion binding
B0070006molecular_functionmetalloaminopeptidase activity
C0005737cellular_componentcytoplasm
C0006508biological_processproteolysis
C0019538biological_processprotein metabolic process
C0030145molecular_functionmanganese ion binding
C0046872molecular_functionmetal ion binding
C0070006molecular_functionmetalloaminopeptidase activity
D0005737cellular_componentcytoplasm
D0006508biological_processproteolysis
D0019538biological_processprotein metabolic process
D0030145molecular_functionmanganese ion binding
D0046872molecular_functionmetal ion binding
D0070006molecular_functionmetalloaminopeptidase activity
E0005737cellular_componentcytoplasm
E0006508biological_processproteolysis
E0019538biological_processprotein metabolic process
E0030145molecular_functionmanganese ion binding
E0046872molecular_functionmetal ion binding
E0070006molecular_functionmetalloaminopeptidase activity
F0005737cellular_componentcytoplasm
F0006508biological_processproteolysis
F0019538biological_processprotein metabolic process
F0030145molecular_functionmanganese ion binding
F0046872molecular_functionmetal ion binding
F0070006molecular_functionmetalloaminopeptidase activity
G0005737cellular_componentcytoplasm
G0006508biological_processproteolysis
G0019538biological_processprotein metabolic process
G0030145molecular_functionmanganese ion binding
G0046872molecular_functionmetal ion binding
G0070006molecular_functionmetalloaminopeptidase activity
H0005737cellular_componentcytoplasm
H0006508biological_processproteolysis
H0019538biological_processprotein metabolic process
H0030145molecular_functionmanganese ion binding
H0046872molecular_functionmetal ion binding
H0070006molecular_functionmetalloaminopeptidase activity
I0005737cellular_componentcytoplasm
I0006508biological_processproteolysis
I0019538biological_processprotein metabolic process
I0030145molecular_functionmanganese ion binding
I0046872molecular_functionmetal ion binding
I0070006molecular_functionmetalloaminopeptidase activity
J0005737cellular_componentcytoplasm
J0006508biological_processproteolysis
J0019538biological_processprotein metabolic process
J0030145molecular_functionmanganese ion binding
J0046872molecular_functionmetal ion binding
J0070006molecular_functionmetalloaminopeptidase activity
K0005737cellular_componentcytoplasm
K0006508biological_processproteolysis
K0019538biological_processprotein metabolic process
K0030145molecular_functionmanganese ion binding
K0046872molecular_functionmetal ion binding
K0070006molecular_functionmetalloaminopeptidase activity
L0005737cellular_componentcytoplasm
L0006508biological_processproteolysis
L0019538biological_processprotein metabolic process
L0030145molecular_functionmanganese ion binding
L0046872molecular_functionmetal ion binding
L0070006molecular_functionmetalloaminopeptidase activity
Functional Information from PDB Data
site_idAC1
Number of Residues7
DetailsBINDING SITE FOR RESIDUE ZN A 1001
ChainResidue
ALYS374
AASP379
AASP399
AGLU461
AZN1003
AR5X1004
AHOH1270

site_idAC2
Number of Residues6
DetailsBINDING SITE FOR RESIDUE CO3 A 1002
ChainResidue
AGLY462
AARG463
ALEU487
AR5X1004
ALYS374
AALA460

site_idAC3
Number of Residues5
DetailsBINDING SITE FOR RESIDUE ZN A 1003
ChainResidue
AASP379
AASP459
AGLU461
AZN1001
AR5X1004

site_idAC4
Number of Residues16
DetailsBINDING SITE FOR RESIDUE R5X A 1004
ChainResidue
ALYS374
AASP379
ALYS386
AMET392
AASP459
AGLU461
ALEU487
ATHR488
AGLY489
ALEU492
AALA577
AZN1001
ACO31002
AZN1003
AHOH1144
AHOH1270

site_idAC5
Number of Residues6
DetailsBINDING SITE FOR RESIDUE SO4 A 1005
ChainResidue
ASER435
ALYS436
BSER435
BLYS436
CSER435
CLYS436

site_idAC6
Number of Residues6
DetailsBINDING SITE FOR RESIDUE SO4 A 1006
ChainResidue
ATYR244
AASP249
ATYR292
ASER295
AHOH1174
CTYR541

site_idAC7
Number of Residues7
DetailsBINDING SITE FOR RESIDUE ZN B 1001
ChainResidue
BLYS374
BASP379
BASP399
BGLU461
BZN1003
BR5X1004
BHOH1225

site_idAC8
Number of Residues7
DetailsBINDING SITE FOR RESIDUE CO3 B 1002
ChainResidue
BLYS374
BALA460
BGLU461
BGLY462
BARG463
BLEU487
BR5X1004

site_idAC9
Number of Residues5
DetailsBINDING SITE FOR RESIDUE ZN B 1003
ChainResidue
BASP379
BASP459
BGLU461
BZN1001
BR5X1004

site_idBC1
Number of Residues16
DetailsBINDING SITE FOR RESIDUE R5X B 1004
ChainResidue
BLYS374
BASP379
BLYS386
BPHE398
BASN457
BASP459
BGLU461
BLEU487
BTHR488
BGLY489
BALA577
BZN1001
BCO31002
BZN1003
BHOH1134
BHOH1225

site_idBC2
Number of Residues4
DetailsBINDING SITE FOR RESIDUE 1PE B 1005
ChainResidue
BTYR103
BGLU316
BLYS320
B1PE1006

site_idBC3
Number of Residues6
DetailsBINDING SITE FOR RESIDUE 1PE B 1006
ChainResidue
BTYR103
BHIS108
BPHE289
BLYS320
BTYR411
B1PE1005

site_idBC4
Number of Residues7
DetailsBINDING SITE FOR RESIDUE ZN C 1001
ChainResidue
CLYS374
CASP379
CASP399
CGLU461
CZN1003
CR5X1004
CHOH1255

site_idBC5
Number of Residues6
DetailsBINDING SITE FOR RESIDUE CO3 C 1002
ChainResidue
CALA460
CGLY462
CARG463
CLEU487
CR5X1004
CLYS374

site_idBC6
Number of Residues5
DetailsBINDING SITE FOR RESIDUE ZN C 1003
ChainResidue
CASP379
CASP459
CGLU461
CZN1001
CR5X1004

site_idBC7
Number of Residues18
DetailsBINDING SITE FOR RESIDUE R5X C 1004
ChainResidue
CLYS374
CASP379
CLYS386
CMET392
CPHE398
CASN457
CASP459
CGLU461
CLEU487
CTHR488
CGLY489
CSER554
CALA577
CZN1001
CCO31002
CZN1003
CHOH1251
CHOH1255

site_idBC8
Number of Residues7
DetailsBINDING SITE FOR RESIDUE ZN D 1001
ChainResidue
DLYS374
DASP379
DASP399
DGLU461
DZN1003
DR5X1004
DHOH1274

site_idBC9
Number of Residues6
DetailsBINDING SITE FOR RESIDUE CO3 D 1002
ChainResidue
DLYS374
DALA460
DGLY462
DARG463
DLEU487
DR5X1004

site_idCC1
Number of Residues5
DetailsBINDING SITE FOR RESIDUE ZN D 1003
ChainResidue
DASP379
DASP459
DGLU461
DZN1001
DR5X1004

site_idCC2
Number of Residues16
DetailsBINDING SITE FOR RESIDUE R5X D 1004
ChainResidue
DLYS374
DASP379
DLYS386
DASN457
DASP459
DGLU461
DLEU487
DTHR488
DGLY489
DLEU492
DSER554
DALA577
DZN1001
DCO31002
DZN1003
DHOH1274

site_idCC3
Number of Residues7
DetailsBINDING SITE FOR RESIDUE ZN E 1001
ChainResidue
ELYS374
EASP379
EASP399
EGLU461
EZN1003
ER5X1004
EHOH1157

site_idCC4
Number of Residues6
DetailsBINDING SITE FOR RESIDUE CO3 E 1002
ChainResidue
ELYS374
EALA460
EGLY462
EARG463
ELEU487
ER5X1004

site_idCC5
Number of Residues6
DetailsBINDING SITE FOR RESIDUE ZN E 1003
ChainResidue
EASP379
ELYS386
EASP459
EGLU461
EZN1001
ER5X1004

site_idCC6
Number of Residues15
DetailsBINDING SITE FOR RESIDUE R5X E 1004
ChainResidue
ELYS374
EASP379
ELYS386
EPHE398
EASN457
EASP459
EGLU461
ELEU487
ETHR488
EGLY489
EZN1001
ECO31002
EZN1003
EHOH1141
EHOH1157

site_idCC7
Number of Residues6
DetailsBINDING SITE FOR RESIDUE SO4 E 1005
ChainResidue
DSER435
DLYS436
ESER435
ELYS436
FSER435
FLYS436

site_idCC8
Number of Residues4
DetailsBINDING SITE FOR RESIDUE 1PE E 1006
ChainResidue
ETYR103
EHIS108
ELEU321
ETYR411

site_idCC9
Number of Residues1
DetailsBINDING SITE FOR RESIDUE 1PE E 1007
ChainResidue
EASN511

site_idDC1
Number of Residues7
DetailsBINDING SITE FOR RESIDUE ZN F 1001
ChainResidue
FLYS374
FASP379
FASP399
FGLU461
FZN1003
FR5X1004
FHOH1219

site_idDC2
Number of Residues4
DetailsBINDING SITE FOR RESIDUE SO4 E 1008
ChainResidue
EGLU102
ETYR103
EASN104
EHOH1178

site_idDC3
Number of Residues6
DetailsBINDING SITE FOR RESIDUE CO3 F 1002
ChainResidue
FLYS374
FALA460
FGLY462
FARG463
FLEU487
FR5X1004

site_idDC4
Number of Residues5
DetailsBINDING SITE FOR RESIDUE ZN F 1003
ChainResidue
FASP379
FASP459
FGLU461
FZN1001
FR5X1004

site_idDC5
Number of Residues17
DetailsBINDING SITE FOR RESIDUE R5X F 1004
ChainResidue
FLYS374
FASP379
FLYS386
FMET392
FPHE398
FASN457
FASP459
FGLU461
FLEU487
FTHR488
FGLY489
FLEU492
FALA577
FZN1001
FCO31002
FZN1003
FHOH1219

site_idDC6
Number of Residues3
DetailsBINDING SITE FOR RESIDUE 1PE F 1005
ChainResidue
FTYR103
FLYS320
FSO41008

site_idDC7
Number of Residues6
DetailsBINDING SITE FOR RESIDUE 1PE F 1006
ChainResidue
FTYR103
FASN104
FHIS108
FLYS320
FTYR411
FHOH1142

site_idDC8
Number of Residues3
DetailsBINDING SITE FOR RESIDUE 1PE F 1007
ChainResidue
FSER93
FLEU94
FASP95

site_idDC9
Number of Residues5
DetailsBINDING SITE FOR RESIDUE SO4 F 1008
ChainResidue
FILE101
FTYR103
FASN104
F1PE1005
FHOH1172

site_idEC1
Number of Residues7
DetailsBINDING SITE FOR RESIDUE ZN G 1001
ChainResidue
GLYS374
GASP379
GASP399
GGLU461
GZN1003
GR5X1004
GHOH1148

site_idEC2
Number of Residues6
DetailsBINDING SITE FOR RESIDUE CO3 G 1002
ChainResidue
GLYS374
GALA460
GGLY462
GARG463
GLEU487
GR5X1004

site_idEC3
Number of Residues5
DetailsBINDING SITE FOR RESIDUE ZN G 1003
ChainResidue
GASP379
GASP459
GGLU461
GZN1001
GR5X1004

site_idEC4
Number of Residues17
DetailsBINDING SITE FOR RESIDUE R5X G 1004
ChainResidue
GLYS374
GASP379
GLYS386
GMET396
GASN457
GASP459
GGLU461
GLEU487
GTHR488
GGLY489
GLEU492
GSER554
GALA577
GZN1001
GCO31002
GZN1003
GHOH1148

site_idEC5
Number of Residues5
DetailsBINDING SITE FOR RESIDUE 1PE G 1005
ChainResidue
GTYR103
GHIS108
GPHE289
GLYS320
GTYR411

site_idEC6
Number of Residues5
DetailsBINDING SITE FOR RESIDUE 1PE G 1006
ChainResidue
GTYR103
GGLU316
GGLN319
GLYS320
GHOH1244

site_idEC7
Number of Residues7
DetailsBINDING SITE FOR RESIDUE ZN H 1001
ChainResidue
HLYS374
HASP379
HASP399
HGLU461
HZN1003
HR5X1004
HHOH1233

site_idEC8
Number of Residues6
DetailsBINDING SITE FOR RESIDUE CO3 H 1002
ChainResidue
HLYS374
HALA460
HGLY462
HARG463
HLEU487
HR5X1004

site_idEC9
Number of Residues5
DetailsBINDING SITE FOR RESIDUE ZN H 1003
ChainResidue
HASP379
HASP459
HGLU461
HZN1001
HR5X1004

site_idFC1
Number of Residues15
DetailsBINDING SITE FOR RESIDUE R5X H 1004
ChainResidue
HLYS374
HASP379
HLYS386
HASN457
HASP459
HGLU461
HLEU487
HTHR488
HGLY489
HALA577
HZN1001
HCO31002
HZN1003
HHOH1136
HHOH1233

site_idFC2
Number of Residues6
DetailsBINDING SITE FOR RESIDUE SO4 H 1005
ChainResidue
GSER435
GLYS436
HSER435
HLYS436
ISER435
ILYS436

site_idFC3
Number of Residues5
DetailsBINDING SITE FOR RESIDUE 1PE H 1006
ChainResidue
HTYR103
HASN104
HHIS108
HLYS320
HTYR411

site_idFC4
Number of Residues7
DetailsBINDING SITE FOR RESIDUE ZN I 1001
ChainResidue
ILYS374
IASP379
IASP399
IGLU461
IZN1003
IR5X1004
IHOH1242

site_idFC5
Number of Residues7
DetailsBINDING SITE FOR RESIDUE CO3 I 1002
ChainResidue
ILYS374
IALA460
IGLU461
IGLY462
IARG463
ILEU487
IR5X1004

site_idFC6
Number of Residues5
DetailsBINDING SITE FOR RESIDUE ZN I 1003
ChainResidue
IASP379
IASP459
IGLU461
IZN1001
IR5X1004

site_idFC7
Number of Residues16
DetailsBINDING SITE FOR RESIDUE R5X I 1004
ChainResidue
ILYS374
IASP379
ILYS386
IMET392
IPHE398
IASP459
IGLU461
IARG463
ILEU487
ITHR488
IGLY489
IALA577
IZN1001
ICO31002
IZN1003
IHOH1242

site_idFC8
Number of Residues3
DetailsBINDING SITE FOR RESIDUE 1PE I 1005
ChainResidue
ITYR103
IGLU316
ILYS320

site_idFC9
Number of Residues5
DetailsBINDING SITE FOR RESIDUE 1PE I 1006
ChainResidue
ITYR103
IASN104
IPHE289
ILYS320
ITYR411

site_idGC1
Number of Residues7
DetailsBINDING SITE FOR RESIDUE ZN J 1001
ChainResidue
JLYS374
JASP379
JASP399
JGLU461
JZN1003
JR5X1004
JHOH1271

site_idGC2
Number of Residues6
DetailsBINDING SITE FOR RESIDUE CO3 J 1002
ChainResidue
JLYS374
JALA460
JGLY462
JARG463
JLEU487
JR5X1004

site_idGC3
Number of Residues5
DetailsBINDING SITE FOR RESIDUE ZN J 1003
ChainResidue
JASP379
JASP459
JGLU461
JZN1001
JR5X1004

site_idGC4
Number of Residues13
DetailsBINDING SITE FOR RESIDUE R5X J 1004
ChainResidue
JLYS374
JASP379
JLYS386
JMET392
JASP459
JGLU461
JLEU487
JTHR488
JGLY489
JALA577
JZN1001
JCO31002
JZN1003

site_idGC5
Number of Residues4
DetailsBINDING SITE FOR RESIDUE 1PE J 1005
ChainResidue
JTYR103
JHIS108
JPHE289
JTYR411

site_idGC6
Number of Residues7
DetailsBINDING SITE FOR RESIDUE ZN K 1001
ChainResidue
KLYS374
KASP379
KASP399
KGLU461
KZN1003
KR5X1004
KHOH1255

site_idGC7
Number of Residues6
DetailsBINDING SITE FOR RESIDUE CO3 K 1002
ChainResidue
KLYS374
KALA460
KGLY462
KARG463
KLEU487
KR5X1004

site_idGC8
Number of Residues5
DetailsBINDING SITE FOR RESIDUE ZN K 1003
ChainResidue
KASP379
KASP459
KGLU461
KZN1001
KR5X1004

site_idGC9
Number of Residues18
DetailsBINDING SITE FOR RESIDUE R5X K 1004
ChainResidue
KLYS374
KASP379
KLYS386
KMET392
KPHE398
KASP459
KGLU461
KLEU487
KTHR488
KGLY489
KLEU492
KSER554
KZN1001
KCO31002
KZN1003
KHOH1181
KHOH1255
KHOH1262

site_idHC1
Number of Residues6
DetailsBINDING SITE FOR RESIDUE SO4 K 1005
ChainResidue
JSER435
JLYS436
KSER435
KLYS436
LSER435
LLYS436

site_idHC2
Number of Residues4
DetailsBINDING SITE FOR RESIDUE 1PE K 1006
ChainResidue
KTYR103
KHIS108
KPHE289
KTYR411

site_idHC3
Number of Residues7
DetailsBINDING SITE FOR RESIDUE ZN L 1001
ChainResidue
LLYS374
LASP379
LASP399
LGLU461
LZN1003
LR5X1004
LHOH1240

site_idHC4
Number of Residues6
DetailsBINDING SITE FOR RESIDUE CO3 L 1002
ChainResidue
LLYS374
LALA460
LGLY462
LARG463
LLEU487
LR5X1004

site_idHC5
Number of Residues5
DetailsBINDING SITE FOR RESIDUE ZN L 1003
ChainResidue
LASP379
LASP459
LGLU461
LZN1001
LR5X1004

site_idHC6
Number of Residues16
DetailsBINDING SITE FOR RESIDUE R5X L 1004
ChainResidue
LLYS374
LASP379
LLYS386
LPHE398
LASN457
LASP459
LGLU461
LLEU487
LTHR488
LGLY489
LSER554
LALA577
LZN1001
LCO31002
LZN1003
LHOH1240

site_idHC7
Number of Residues4
DetailsBINDING SITE FOR RESIDUE 1PE L 1005
ChainResidue
LTYR103
LASN104
LHIS108
LTYR411

Functional Information from PROSITE/UniProt
site_idPS00631
Number of Residues8
DetailsCYTOSOL_AP Cytosol aminopeptidase signature. NTDAEGRL
ChainResidueDetails
AASN457-LEU464

Functional Information from SwissProt/UniProt
site_idSWS_FT_FI1
Number of Residues204
DetailsRegion: {"description":"L13 loop","evidences":[{"source":"PubMed","id":"35691342","evidenceCode":"ECO:0000269"}]}
ChainResidueDetails

site_idSWS_FT_FI2
Number of Residues24
DetailsActive site: {"evidences":[{"source":"UniProtKB","id":"P00727","evidenceCode":"ECO:0000250"}]}
ChainResidueDetails

site_idSWS_FT_FI3
Number of Residues36
DetailsBinding site: {"evidences":[{"source":"PubMed","id":"20133789","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"21844374","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"23713488","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"25299353","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"25645579","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"35691342","evidenceCode":"ECO:0000269"},{"source":"Reference","evidenceCode":"ECO:0000269","citation":{"citationType":"submission","publicationDate":"JUL-2021","submissionDatabase":"PDB data bank","title":"Structure of M17 with compound.","authors":["Edgar R.","McGowan S.","Webb C.T."]}},{"source":"PDB","id":"3T8W","evidenceCode":"ECO:0000312"},{"source":"PDB","id":"3KQX","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"3KQZ","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"3KR4","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"3KR5","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"4K3N","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"4R6T","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"4R76","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"4R7M","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"4X2T","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"7RIE","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"7T3V","evidenceCode":"ECO:0007744"}]}
ChainResidueDetails

site_idSWS_FT_FI4
Number of Residues12
DetailsBinding site: {"evidences":[{"source":"PubMed","id":"20133789","evidenceCode":"ECO:0000305"},{"source":"PubMed","id":"23713488","evidenceCode":"ECO:0000305"},{"source":"PDB","id":"3KR5","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"4K3N","evidenceCode":"ECO:0007744"}]}
ChainResidueDetails

site_idSWS_FT_FI5
Number of Residues36
DetailsBinding site: {"evidences":[{"source":"PubMed","id":"35691342","evidenceCode":"ECO:0000269"},{"source":"PDB","id":"7SRV","evidenceCode":"ECO:0007744"}]}
ChainResidueDetails

site_idSWS_FT_FI6
Number of Residues12
DetailsBinding site: {"evidences":[{"source":"PubMed","id":"20133789","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"21844374","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"23713488","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"25299353","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"25645579","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"35691342","evidenceCode":"ECO:0000269"},{"source":"Reference","evidenceCode":"ECO:0000269","citation":{"citationType":"submission","publicationDate":"JUL-2021","submissionDatabase":"PDB data bank","title":"Structure of M17 with compound.","authors":["Edgar R.","McGowan S.","Webb C.T."]}},{"source":"PDB","id":"3KQZ","evidenceCode":"ECO:0000312"},{"source":"PDB","id":"3T8W","evidenceCode":"ECO:0000312"},{"source":"PDB","id":"3KR4","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"3KR5","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"4K3N","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"4R6T","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"4R76","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"4R7M","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"4X2T","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"7RIE","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"7T3V","evidenceCode":"ECO:0007744"}]}
ChainResidueDetails

site_idSWS_FT_FI7
Number of Residues12
DetailsSite: {"description":"Essential for hexamer stabilization","evidences":[{"source":"PubMed","id":"35691342","evidenceCode":"ECO:0000269"}]}
ChainResidueDetails

246704

PDB entries from 2025-12-24

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