Summary Structural details Experimental details Functional details Sequence Neighbor History Downloads

3T8W

A bestatin-based chemical biology strategy reveals distinct roles for malaria M1- and M17-family aminopeptidases

Functional Information from GO Data

Chain	GOid	namespace	contents
A	0005737	cellular_component	cytoplasm
A	0006508	biological_process	proteolysis
A	0019538	biological_process	protein metabolic process
A	0030145	molecular_function	manganese ion binding
A	0046872	molecular_function	metal ion binding
A	0070006	molecular_function	metalloaminopeptidase activity
B	0005737	cellular_component	cytoplasm
B	0006508	biological_process	proteolysis
B	0019538	biological_process	protein metabolic process
B	0030145	molecular_function	manganese ion binding
B	0046872	molecular_function	metal ion binding
B	0070006	molecular_function	metalloaminopeptidase activity
C	0005737	cellular_component	cytoplasm
C	0006508	biological_process	proteolysis
C	0019538	biological_process	protein metabolic process
C	0030145	molecular_function	manganese ion binding
C	0046872	molecular_function	metal ion binding
C	0070006	molecular_function	metalloaminopeptidase activity
D	0005737	cellular_component	cytoplasm
D	0006508	biological_process	proteolysis
D	0019538	biological_process	protein metabolic process
D	0030145	molecular_function	manganese ion binding
D	0046872	molecular_function	metal ion binding
D	0070006	molecular_function	metalloaminopeptidase activity
E	0005737	cellular_component	cytoplasm
E	0006508	biological_process	proteolysis
E	0019538	biological_process	protein metabolic process
E	0030145	molecular_function	manganese ion binding
E	0046872	molecular_function	metal ion binding
E	0070006	molecular_function	metalloaminopeptidase activity
F	0005737	cellular_component	cytoplasm
F	0006508	biological_process	proteolysis
F	0019538	biological_process	protein metabolic process
F	0030145	molecular_function	manganese ion binding
F	0046872	molecular_function	metal ion binding
F	0070006	molecular_function	metalloaminopeptidase activity
G	0005737	cellular_component	cytoplasm
G	0006508	biological_process	proteolysis
G	0019538	biological_process	protein metabolic process
G	0030145	molecular_function	manganese ion binding
G	0046872	molecular_function	metal ion binding
G	0070006	molecular_function	metalloaminopeptidase activity
H	0005737	cellular_component	cytoplasm
H	0006508	biological_process	proteolysis
H	0019538	biological_process	protein metabolic process
H	0030145	molecular_function	manganese ion binding
H	0046872	molecular_function	metal ion binding
H	0070006	molecular_function	metalloaminopeptidase activity
I	0005737	cellular_component	cytoplasm
I	0006508	biological_process	proteolysis
I	0019538	biological_process	protein metabolic process
I	0030145	molecular_function	manganese ion binding
I	0046872	molecular_function	metal ion binding
I	0070006	molecular_function	metalloaminopeptidase activity
J	0005737	cellular_component	cytoplasm
J	0006508	biological_process	proteolysis
J	0019538	biological_process	protein metabolic process
J	0030145	molecular_function	manganese ion binding
J	0046872	molecular_function	metal ion binding
J	0070006	molecular_function	metalloaminopeptidase activity
K	0005737	cellular_component	cytoplasm
K	0006508	biological_process	proteolysis
K	0019538	biological_process	protein metabolic process
K	0030145	molecular_function	manganese ion binding
K	0046872	molecular_function	metal ion binding
K	0070006	molecular_function	metalloaminopeptidase activity
L	0005737	cellular_component	cytoplasm
L	0006508	biological_process	proteolysis
L	0019538	biological_process	protein metabolic process
L	0030145	molecular_function	manganese ion binding
L	0046872	molecular_function	metal ion binding
L	0070006	molecular_function	metalloaminopeptidase activity

Functional Information from PDB Data

site_id	AC1
Number of Residues	6
Details	BINDING SITE FOR RESIDUE CO3 A 612

Chain	Residue
A	LYS374
A	ALA460
A	GLY462
A	ARG463
A	LEU487
A	DGZ615

site_id	AC2
Number of Residues	5
Details	BINDING SITE FOR RESIDUE ZN A 613

Chain	Residue
A	ZN614
A	DGZ615
A	ASP379
A	ASP459
A	GLU461

site_id	AC3
Number of Residues	6
Details	BINDING SITE FOR RESIDUE ZN A 614

Chain	Residue
A	LYS374
A	ASP379
A	ASP399
A	GLU461
A	ZN613
A	DGZ615

site_id	AC4
Number of Residues	28
Details	BINDING SITE FOR RESIDUE DGZ A 615

Chain	Residue
A	LYS374
A	ASP379
A	LYS386
A	ALA388
A	PRO389
A	GLY390
A	MET392
A	ASP399
A	ASN457
A	ASP459
A	GLU461
A	ARG463
A	THR486
A	LEU487
A	THR488
A	GLY489
A	ALA490
A	TYR493
A	ILE547
A	SER554
A	CO3612
A	ZN613
A	ZN614
A	HOH890
A	HOH906
F	TYR493
F	LYS552
F	DGZ615

site_id	AC5
Number of Residues	6
Details	BINDING SITE FOR RESIDUE SO4 A 616

Chain	Residue
A	ILE101
A	GLU102
A	TYR103
A	ASN104
A	1PE619
A	HOH710

site_id	AC6
Number of Residues	6
Details	BINDING SITE FOR RESIDUE SO4 A 617

Chain	Residue
A	GLU125
A	GLY126
A	LEU219
A	SER220
A	HOH811
D	LYS164

site_id	AC7
Number of Residues	5
Details	BINDING SITE FOR RESIDUE 1PE A 618

Chain	Residue
A	TYR103
A	ASN104
A	HIS108
A	PHE289
A	TYR411

site_id	AC8
Number of Residues	4
Details	BINDING SITE FOR RESIDUE 1PE A 619

Chain	Residue
A	TYR103
A	GLU316
A	LYS320
A	SO4616

site_id	AC9
Number of Residues	6
Details	BINDING SITE FOR RESIDUE CO3 B 612

Chain	Residue
B	LYS374
B	ALA460
B	GLY462
B	ARG463
B	LEU487
B	DGZ615

site_id	BC1
Number of Residues	5
Details	BINDING SITE FOR RESIDUE ZN B 613

Chain	Residue
B	ASP379
B	ASP459
B	GLU461
B	ZN614
B	DGZ615

site_id	BC2
Number of Residues	6
Details	BINDING SITE FOR RESIDUE ZN B 614

Chain	Residue
B	LYS374
B	ASP379
B	ASP399
B	GLU461
B	ZN613
B	DGZ615

site_id	BC3
Number of Residues	29
Details	BINDING SITE FOR RESIDUE DGZ B 615

Chain	Residue
B	ALA490
B	TYR493
B	SER548
B	CO3612
B	ZN613
B	ZN614
B	HOH621
B	HOH672
B	HOH718
B	HOH819
E	TYR493
E	LYS552
E	DGZ615
B	LYS374
B	ASP379
B	LYS386
B	ALA388
B	PRO389
B	GLY390
B	MET392
B	MET396
B	ASP399
B	ASN457
B	ASP459
B	GLU461
B	THR486
B	LEU487
B	THR488
B	GLY489

site_id	BC4
Number of Residues	8
Details	BINDING SITE FOR RESIDUE 2PE B 616

Chain	Residue
B	TYR103
B	ASN104
B	LYS320
B	TYR411
H	TYR103
H	GLU316
H	LYS320
H	2PE619

site_id	BC5
Number of Residues	7
Details	BINDING SITE FOR RESIDUE CO3 C 612

Chain	Residue
C	LYS374
C	ALA460
C	GLU461
C	GLY462
C	ARG463
C	LEU487
C	DGZ615

site_id	BC6
Number of Residues	6
Details	BINDING SITE FOR RESIDUE ZN C 613

Chain	Residue
C	LYS374
C	ASP379
C	ASP399
C	GLU461
C	ZN614
C	DGZ615

site_id	BC7
Number of Residues	5
Details	BINDING SITE FOR RESIDUE ZN C 614

Chain	Residue
C	ASP379
C	ASP459
C	GLU461
C	ZN613
C	DGZ615

site_id	BC8
Number of Residues	28
Details	BINDING SITE FOR RESIDUE DGZ C 615

Chain	Residue
C	LYS374
C	ASP379
C	LYS386
C	ALA388
C	PRO389
C	GLY390
C	MET392
C	MET396
C	PHE398
C	ASP399
C	ASN457
C	ASP459
C	GLU461
C	ARG463
C	THR486
C	LEU487
C	THR488
C	GLY489
C	ALA490
C	TYR493
C	SER554
C	CO3612
C	ZN613
C	ZN614
C	HOH861
C	HOH883
D	TYR493
D	DGZ615

site_id	BC9
Number of Residues	8
Details	BINDING SITE FOR RESIDUE SO4 C 616

Chain	Residue
A	SER435
A	LYS436
B	SER435
B	LYS436
B	HOH831
C	SER435
C	LYS436
C	HOH953

site_id	CC1
Number of Residues	4
Details	BINDING SITE FOR RESIDUE SO4 C 617

Chain	Residue
C	GLY126
C	LEU219
C	SER220
E	LYS164

site_id	CC2
Number of Residues	4
Details	BINDING SITE FOR RESIDUE SO4 C 618

Chain	Residue
C	ASN505
C	ASN506
C	THR569
C	ALA570

site_id	CC3
Number of Residues	10
Details	BINDING SITE FOR RESIDUE SO4 C 619

Chain	Residue
C	LEU214
C	HIS215
C	ASP216
C	ASN217
C	ASN260
C	MET261
C	GLU262
C	HOH858
C	HOH923
C	HOH1032

site_id	CC4
Number of Residues	6
Details	BINDING SITE FOR RESIDUE SO4 C 620

Chain	Residue
C	ILE529
C	ILE530
C	ASN531
C	HOH879
C	HOH1041
D	TYR499

site_id	CC5
Number of Residues	4
Details	BINDING SITE FOR RESIDUE 1PE C 621

Chain	Residue
C	TYR103
C	ASN104
C	GLU316
C	LYS320

site_id	CC6
Number of Residues	4
Details	BINDING SITE FOR RESIDUE 1PE C 622

Chain	Residue
C	TYR103
C	HIS108
C	PHE289
C	TYR411

site_id	CC7
Number of Residues	7
Details	BINDING SITE FOR RESIDUE CO3 D 612

Chain	Residue
D	LYS374
D	ALA460
D	GLU461
D	GLY462
D	ARG463
D	LEU487
D	DGZ615

site_id	CC8
Number of Residues	6
Details	BINDING SITE FOR RESIDUE ZN D 613

Chain	Residue
D	LYS374
D	ASP379
D	ASP399
D	GLU461
D	ZN614
D	DGZ615

site_id	CC9
Number of Residues	5
Details	BINDING SITE FOR RESIDUE ZN D 614

Chain	Residue
D	ASP379
D	ASP459
D	GLU461
D	ZN613
D	DGZ615

site_id	DC1
Number of Residues	29
Details	BINDING SITE FOR RESIDUE DGZ D 615

Chain	Residue
C	TYR493
C	DGZ615
D	LYS374
D	ASP379
D	LYS386
D	ALA388
D	PRO389
D	GLY390
D	MET392
D	PHE398
D	ASP399
D	ASN457
D	ASP459
D	GLU461
D	ARG463
D	THR486
D	LEU487
D	THR488
D	GLY489
D	ALA490
D	TYR493
D	ILE547
D	SER550
D	CO3612
D	ZN613
D	ZN614
D	HOH636
D	HOH862
D	HOH1044

site_id	DC2
Number of Residues	4
Details	BINDING SITE FOR RESIDUE SO4 D 616

Chain	Residue
D	GLU102
D	TYR103
D	ASN104
D	HOH902

site_id	DC3
Number of Residues	6
Details	BINDING SITE FOR RESIDUE SO4 D 617

Chain	Residue
D	SER435
D	LYS436
E	SER435
E	LYS436
F	SER435
F	LYS436

site_id	DC4
Number of Residues	6
Details	BINDING SITE FOR RESIDUE 1PE D 618

Chain	Residue
D	TYR103
D	ASN104
D	HIS108
D	LYS320
D	TYR411
D	HOH745

site_id	DC5
Number of Residues	5
Details	BINDING SITE FOR RESIDUE 1PE D 619

Chain	Residue
C	TRP526
D	SER517
D	LYS518
D	VAL524
D	HOH838

site_id	DC6
Number of Residues	7
Details	BINDING SITE FOR RESIDUE 1PE D 620

Chain	Residue
D	ASN449
D	LYS451
D	ARG534
D	ASP543
D	GLU564
D	GLN567
E	SER254

site_id	DC7
Number of Residues	7
Details	BINDING SITE FOR RESIDUE 1PE D 621

Chain	Residue
A	PHE156
A	ASN161
A	LYS164
A	PHE165
D	MET177
D	PHE178
D	SER184

site_id	DC8
Number of Residues	7
Details	BINDING SITE FOR RESIDUE CO3 E 612

Chain	Residue
E	LYS374
E	ALA460
E	GLU461
E	GLY462
E	ARG463
E	LEU487
E	DGZ615

site_id	DC9
Number of Residues	6
Details	BINDING SITE FOR RESIDUE ZN E 613

Chain	Residue
E	LYS374
E	ASP379
E	ASP399
E	GLU461
E	ZN614
E	DGZ615

site_id	EC1
Number of Residues	5
Details	BINDING SITE FOR RESIDUE ZN E 614

Chain	Residue
E	ASP379
E	ASP459
E	GLU461
E	ZN613
E	DGZ615

site_id	EC2
Number of Residues	29
Details	BINDING SITE FOR RESIDUE DGZ E 615

Chain	Residue
B	TYR493
B	DGZ615
E	LYS374
E	ASP379
E	LYS386
E	ALA388
E	PRO389
E	GLY390
E	MET392
E	PHE398
E	ASP399
E	ASN457
E	ASP459
E	GLU461
E	ARG463
E	THR486
E	LEU487
E	THR488
E	GLY489
E	ALA490
E	TYR493
E	ILE547
E	SER548
E	SER550
E	CO3612
E	ZN613
E	ZN614
E	HOH721
E	HOH911

site_id	EC3
Number of Residues	7
Details	BINDING SITE FOR RESIDUE SO4 E 616

Chain	Residue
E	ASN505
E	ASN506
E	THR569
E	ALA570
E	HOH997
E	HOH1031
E	HOH1036

site_id	EC4
Number of Residues	6
Details	BINDING SITE FOR RESIDUE SO4 E 617

Chain	Residue
E	GLU102
E	TYR103
E	ASN104
E	1PE619
E	HOH754
E	HOH1017

site_id	EC5
Number of Residues	6
Details	BINDING SITE FOR RESIDUE SO4 E 618

Chain	Residue
C	PHE156
C	ASN161
C	LYS164
E	TYR176
E	MET177
E	SER184

site_id	EC6
Number of Residues	5
Details	BINDING SITE FOR RESIDUE 1PE E 619

Chain	Residue
E	TYR103
E	GLU316
E	LYS320
E	SO4617
E	HOH1027

site_id	EC7
Number of Residues	2
Details	BINDING SITE FOR RESIDUE 1PE E 620

Chain	Residue
E	TYR103
E	TYR411

site_id	EC8
Number of Residues	6
Details	BINDING SITE FOR RESIDUE 1PE E 621

Chain	Residue
E	LYS451
E	ARG534
E	ASP543
E	GLU564
E	HOH941
F	SER254

site_id	EC9
Number of Residues	6
Details	BINDING SITE FOR RESIDUE CO3 F 612

Chain	Residue
F	LYS374
F	ALA460
F	GLY462
F	ARG463
F	LEU487
F	DGZ615

site_id	FC1
Number of Residues	6
Details	BINDING SITE FOR RESIDUE ZN F 613

Chain	Residue
F	LYS374
F	ASP379
F	ASP399
F	GLU461
F	ZN614
F	DGZ615

site_id	FC2
Number of Residues	5
Details	BINDING SITE FOR RESIDUE ZN F 614

Chain	Residue
F	ASP379
F	ASP459
F	GLU461
F	ZN613
F	DGZ615

site_id	FC3
Number of Residues	30
Details	BINDING SITE FOR RESIDUE DGZ F 615

Chain	Residue
A	TYR493
A	DGZ615
F	LYS374
F	ASP379
F	LYS386
F	ALA388
F	PRO389
F	GLY390
F	MET392
F	PHE398
F	ASP399
F	ASN457
F	ASP459
F	GLU461
F	THR486
F	LEU487
F	THR488
F	GLY489
F	ALA490
F	TYR493
F	ILE547
F	SER548
F	VAL551
F	ALA577
F	CO3612
F	ZN613
F	ZN614
F	HOH712
F	HOH835
F	HOH939

site_id	FC4
Number of Residues	5
Details	BINDING SITE FOR RESIDUE 1PE F 616

Chain	Residue
F	TYR103
F	ASN104
F	HIS108
F	LYS320
F	TYR411

site_id	FC5
Number of Residues	5
Details	BINDING SITE FOR RESIDUE 1PE F 617

Chain	Residue
F	TYR103
F	GLU316
F	GLN319
F	LYS320
F	HOH794

site_id	FC6
Number of Residues	6
Details	BINDING SITE FOR RESIDUE 1PE F 618

Chain	Residue
D	SER254
F	ASN449
F	LYS451
F	ASP543
F	GLN567
F	HOH871

site_id	FC7
Number of Residues	8
Details	BINDING SITE FOR RESIDUE CO3 G 612

Chain	Residue
G	LYS374
G	ALA460
G	GLU461
G	GLY462
G	ARG463
G	LEU487
G	ZN613
G	DGZ615

site_id	FC8
Number of Residues	7
Details	BINDING SITE FOR RESIDUE ZN G 613

Chain	Residue
G	LYS374
G	ASP379
G	ASP399
G	GLU461
G	CO3612
G	ZN614
G	DGZ615

site_id	FC9
Number of Residues	5
Details	BINDING SITE FOR RESIDUE ZN G 614

Chain	Residue
G	ASP379
G	ASP459
G	GLU461
G	ZN613
G	DGZ615

site_id	GC1
Number of Residues	26
Details	BINDING SITE FOR RESIDUE DGZ G 615

Chain	Residue
G	LYS374
G	ASP379
G	LYS386
G	ALA388
G	PRO389
G	GLY390
G	MET392
G	PHE398
G	ASP399
G	ASN457
G	ASP459
G	GLU461
G	THR486
G	LEU487
G	THR488
G	GLY489
G	ALA490
G	TYR493
G	SER554
G	CO3612
G	ZN613
G	ZN614
G	HOH746
G	HOH905
L	TYR493
L	DGZ615

site_id	GC2
Number of Residues	5
Details	BINDING SITE FOR RESIDUE SO4 G 616

Chain	Residue
G	ILE101
G	GLU102
G	TYR103
G	ASN104
G	1PE623

site_id	GC3
Number of Residues	6
Details	BINDING SITE FOR RESIDUE SO4 G 617

Chain	Residue
G	PHE156
G	ASN161
G	PHE165
G	HOH866
J	TYR176
J	SER184

site_id	GC4
Number of Residues	6
Details	BINDING SITE FOR RESIDUE SO4 G 618

Chain	Residue
G	GLU125
G	GLY126
G	LEU219
G	SER220
G	HOH804
G	HOH1016

site_id	GC5
Number of Residues	6
Details	BINDING SITE FOR RESIDUE SO4 G 619

Chain	Residue
G	TYR244
G	ASP249
G	TYR292
G	SER295
G	HOH678
I	TYR541

site_id	GC6
Number of Residues	6
Details	BINDING SITE FOR RESIDUE 1PE G 620

Chain	Residue
G	TYR103
G	ASN104
G	HIS108
G	LYS320
G	TYR411
G	1PE623

site_id	GC7
Number of Residues	9
Details	BINDING SITE FOR RESIDUE 1PE G 621

Chain	Residue
A	TYR115
A	ASN122
A	GLU124
A	TYR270
G	TYR115
G	ASN122
G	GLU124
G	TYR270
G	1PE622

site_id	GC8
Number of Residues	6
Details	BINDING SITE FOR RESIDUE 1PE G 622

Chain	Residue
A	ASN122
A	TYR270
G	ASN122
G	TYR270
G	1PE621
G	HOH986

site_id	GC9
Number of Residues	7
Details	BINDING SITE FOR RESIDUE 1PE G 623

Chain	Residue
G	TYR103
G	ASN104
G	GLU316
G	LYS320
G	SO4616
G	1PE620
G	HOH980

site_id	HC1
Number of Residues	7
Details	BINDING SITE FOR RESIDUE CO3 H 612

Chain	Residue
H	LYS374
H	ALA460
H	GLU461
H	GLY462
H	ARG463
H	LEU487
H	DGZ615

site_id	HC2
Number of Residues	6
Details	BINDING SITE FOR RESIDUE ZN H 613

Chain	Residue
H	LYS374
H	ASP379
H	ASP399
H	GLU461
H	ZN614
H	DGZ615

site_id	HC3
Number of Residues	5
Details	BINDING SITE FOR RESIDUE ZN H 614

Chain	Residue
H	ASP379
H	ASP459
H	GLU461
H	ZN613
H	DGZ615

site_id	HC4
Number of Residues	31
Details	BINDING SITE FOR RESIDUE DGZ H 615

Chain	Residue
H	LYS374
H	ASP379
H	LYS386
H	ALA388
H	PRO389
H	GLY390
H	MET392
H	MET396
H	PHE398
H	ASP399
H	ASN457
H	ASP459
H	GLU461
H	ARG463
H	THR486
H	LEU487
H	THR488
H	GLY489
H	ALA490
H	TYR493
H	SER548
H	SER550
H	CO3612
H	ZN613
H	ZN614
H	HOH656
H	HOH776
H	HOH890
K	TYR493
K	LYS552
K	DGZ615

site_id	HC5
Number of Residues	7
Details	BINDING SITE FOR RESIDUE SO4 H 616

Chain	Residue
G	SER435
G	LYS436
H	SER435
H	LYS436
H	HOH797
I	SER435
I	LYS436

site_id	HC6
Number of Residues	5
Details	BINDING SITE FOR RESIDUE SO4 H 617

Chain	Residue
H	SER86
H	GLU87
H	VAL88
H	THR97
H	ASN312

site_id	HC7
Number of Residues	8
Details	BINDING SITE FOR RESIDUE SO4 H 618

Chain	Residue
G	TYR541
H	TYR244
H	ASP249
H	TYR292
H	SER295
H	LYS587
H	HOH647
H	HOH693

site_id	HC8
Number of Residues	8
Details	BINDING SITE FOR RESIDUE 2PE H 619

Chain	Residue
B	TYR103
B	GLU316
B	LYS320
B	2PE616
B	HOH846
H	TYR103
H	LYS320
H	TYR411

site_id	HC9
Number of Residues	8
Details	BINDING SITE FOR RESIDUE CO3 I 612

Chain	Residue
I	LYS374
I	ALA460
I	GLU461
I	GLY462
I	ARG463
I	LEU487
I	ZN613
I	DGZ615

site_id	IC1
Number of Residues	7
Details	BINDING SITE FOR RESIDUE ZN I 613

Chain	Residue
I	LYS374
I	ASP379
I	ASP399
I	GLU461
I	CO3612
I	ZN614
I	DGZ615

site_id	IC2
Number of Residues	5
Details	BINDING SITE FOR RESIDUE ZN I 614

Chain	Residue
I	ASP379
I	ASP459
I	GLU461
I	ZN613
I	DGZ615

site_id	IC3
Number of Residues	31
Details	BINDING SITE FOR RESIDUE DGZ I 615

Chain	Residue
I	LYS374
I	ASP379
I	LYS386
I	ALA388
I	PRO389
I	GLY390
I	MET392
I	MET396
I	PHE398
I	ASP399
I	ASN457
I	ASP459
I	GLU461
I	ARG463
I	THR486
I	LEU487
I	THR488
I	GLY489
I	ALA490
I	TYR493
I	ILE547
I	SER548
I	SER554
I	CO3612
I	ZN613
I	ZN614
I	HOH797
I	HOH834
I	HOH899
J	TYR493
J	DGZ615

site_id	IC4
Number of Residues	5
Details	BINDING SITE FOR RESIDUE SO4 I 616

Chain	Residue
I	GLU102
I	TYR103
I	ASN104
I	1PE621
I	HOH835

site_id	IC5
Number of Residues	7
Details	BINDING SITE FOR RESIDUE SO4 I 617

Chain	Residue
I	PHE156
I	ASN161
I	LYS164
K	TYR176
K	MET177
K	PHE178
K	SER184

site_id	IC6
Number of Residues	8
Details	BINDING SITE FOR RESIDUE SO4 I 618

Chain	Residue
I	LEU214
I	HIS215
I	ASP216
I	ASN217
I	ASN260
I	MET261
I	GLU262
I	HOH928

site_id	IC7
Number of Residues	6
Details	BINDING SITE FOR RESIDUE SO4 I 619

Chain	Residue
I	GLU125
I	GLY126
I	LEU219
I	SER220
I	HOH921
I	HOH974

site_id	IC8
Number of Residues	6
Details	BINDING SITE FOR RESIDUE SO4 I 620

Chain	Residue
I	SER86
I	GLU87
I	VAL88
I	THR97
I	ASN312
I	HOH658

site_id	IC9
Number of Residues	4
Details	BINDING SITE FOR RESIDUE 1PE I 621

Chain	Residue
I	TYR103
I	GLU316
I	LYS320
I	SO4616

site_id	JC1
Number of Residues	4
Details	BINDING SITE FOR RESIDUE 1PE I 622

Chain	Residue
I	TYR103
I	ASN104
I	HIS108
I	TYR411

site_id	JC2
Number of Residues	7
Details	BINDING SITE FOR RESIDUE 1PE I 623

Chain	Residue
I	ILE529
I	ILE530
I	ASN531
I	GLU532
I	HOH691
J	TYR499
J	HOH837

site_id	JC3
Number of Residues	7
Details	BINDING SITE FOR RESIDUE CO3 J 612

Chain	Residue
J	LYS374
J	ALA460
J	GLU461
J	GLY462
J	ARG463
J	LEU487
J	DGZ615

site_id	JC4
Number of Residues	6
Details	BINDING SITE FOR RESIDUE ZN J 613

Chain	Residue
J	LYS374
J	ASP379
J	ASP399
J	GLU461
J	ZN614
J	DGZ615

site_id	JC5
Number of Residues	5
Details	BINDING SITE FOR RESIDUE ZN J 614

Chain	Residue
J	ASP379
J	ASP459
J	GLU461
J	ZN613
J	DGZ615

site_id	JC6
Number of Residues	27
Details	BINDING SITE FOR RESIDUE DGZ J 615

Chain	Residue
I	TYR493
I	DGZ615
J	LYS374
J	ASP379
J	LYS386
J	ALA388
J	PRO389
J	GLY390
J	MET392
J	PHE398
J	ASP399
J	ASN457
J	ASP459
J	GLU461
J	THR486
J	LEU487
J	THR488
J	GLY489
J	ALA490
J	TYR493
J	ILE547
J	SER550
J	CO3612
J	ZN613
J	ZN614
J	HOH643
J	HOH871

site_id	JC7
Number of Residues	6
Details	BINDING SITE FOR RESIDUE SO4 J 616

Chain	Residue
J	SER435
J	LYS436
K	SER435
K	LYS436
L	SER435
L	LYS436

site_id	JC8
Number of Residues	4
Details	BINDING SITE FOR RESIDUE SO4 J 617

Chain	Residue
J	ILE101
J	GLU102
J	TYR103
J	ASN104

site_id	JC9
Number of Residues	7
Details	BINDING SITE FOR RESIDUE SO4 J 618

Chain	Residue
J	SER86
J	GLU87
J	VAL88
J	THR97
J	ASN312
J	HOH727
J	HOH829

site_id	KC1
Number of Residues	7
Details	BINDING SITE FOR RESIDUE 1PE J 619

Chain	Residue
J	TYR103
J	ASN104
J	HIS108
J	PHE289
J	LYS320
J	TYR411
J	HOH954

site_id	KC2
Number of Residues	4
Details	BINDING SITE FOR RESIDUE 1PE J 620

Chain	Residue
J	TYR103
J	GLU316
J	LYS320
J	HOH732

site_id	KC3
Number of Residues	6
Details	BINDING SITE FOR RESIDUE 1PE J 621

Chain	Residue
J	ASN449
J	LYS451
J	ARG534
J	ASP543
J	GLU564
K	SER254

site_id	KC4
Number of Residues	6
Details	BINDING SITE FOR RESIDUE 1PE J 622

Chain	Residue
J	LEU514
J	SER517
J	LYS518
J	VAL524
J	HOH658
J	HOH682

site_id	KC5
Number of Residues	6
Details	BINDING SITE FOR RESIDUE CO3 K 612

Chain	Residue
K	LYS374
K	ALA460
K	GLY462
K	ARG463
K	LEU487
K	DGZ615

site_id	KC6
Number of Residues	6
Details	BINDING SITE FOR RESIDUE ZN K 613

Chain	Residue
K	LYS374
K	ASP379
K	ASP399
K	GLU461
K	ZN614
K	DGZ615

site_id	KC7
Number of Residues	5
Details	BINDING SITE FOR RESIDUE ZN K 614

Chain	Residue
K	ASP379
K	ASP459
K	GLU461
K	ZN613
K	DGZ615

site_id	KC8
Number of Residues	31
Details	BINDING SITE FOR RESIDUE DGZ K 615

Chain	Residue
H	TYR493
H	SER550
H	DGZ615
K	LYS374
K	ASP379
K	LYS386
K	ALA388
K	PRO389
K	GLY390
K	MET392
K	MET396
K	PHE398
K	ASP399
K	ASN457
K	ASP459
K	GLU461
K	ARG463
K	THR486
K	LEU487
K	THR488
K	GLY489
K	ALA490
K	TYR493
K	SER548
K	SER550
K	ALA577
K	CO3612
K	ZN613
K	ZN614
K	HOH768
K	HOH845

site_id	KC9
Number of Residues	4
Details	BINDING SITE FOR RESIDUE SO4 K 616

Chain	Residue
K	GLU102
K	TYR103
K	ASN104
K	1PE617

site_id	LC1
Number of Residues	3
Details	BINDING SITE FOR RESIDUE 1PE K 617

Chain	Residue
K	GLU316
K	LYS320
K	SO4616

site_id	LC2
Number of Residues	6
Details	BINDING SITE FOR RESIDUE 1PE K 618

Chain	Residue
K	TYR103
K	HIS108
K	PHE289
K	LYS320
K	TYR411
K	HOH917

site_id	LC3
Number of Residues	8
Details	BINDING SITE FOR RESIDUE 1PE K 619

Chain	Residue
K	ASN449
K	LYS451
K	ARG534
K	ASP543
K	GLU564
K	GLN567
K	HOH675
L	SER254

site_id	LC4
Number of Residues	3
Details	BINDING SITE FOR RESIDUE 1PE K 620

Chain	Residue
K	ASP95
K	PRO96
K	THR97

site_id	LC5
Number of Residues	7
Details	BINDING SITE FOR RESIDUE CO3 L 612

Chain	Residue
L	LYS374
L	ALA460
L	GLU461
L	GLY462
L	ARG463
L	LEU487
L	DGZ615

site_id	LC6
Number of Residues	5
Details	BINDING SITE FOR RESIDUE ZN L 613

Chain	Residue
L	ASP379
L	ASP459
L	GLU461
L	ZN614
L	DGZ615

site_id	LC7
Number of Residues	6
Details	BINDING SITE FOR RESIDUE ZN L 614

Chain	Residue
L	LYS374
L	ASP379
L	ASP399
L	GLU461
L	ZN613
L	DGZ615

site_id	LC8
Number of Residues	30
Details	BINDING SITE FOR RESIDUE DGZ L 615

Chain	Residue
G	TYR493
G	DGZ615
L	LYS374
L	ASP379
L	LYS386
L	ALA388
L	PRO389
L	GLY390
L	MET392
L	MET396
L	PHE398
L	ASP399
L	ASN457
L	ASP459
L	GLU461
L	ARG463
L	THR486
L	LEU487
L	THR488
L	GLY489
L	ALA490
L	TYR493
L	SER548
L	ALA577
L	CO3612
L	ZN613
L	ZN614
L	HOH704
L	HOH786
L	HOH787

site_id	LC9
Number of Residues	6
Details	BINDING SITE FOR RESIDUE SO4 L 616

Chain	Residue
L	SER86
L	GLU87
L	VAL88
L	THR97
L	ASN312
L	HOH643

site_id	MC1
Number of Residues	5
Details	BINDING SITE FOR RESIDUE 1PE L 617

Chain	Residue
L	TYR103
L	ASN104
L	HIS108
L	LYS320
L	TYR411

site_id	MC2
Number of Residues	7
Details	BINDING SITE FOR RESIDUE 1PE L 618

Chain	Residue
J	SER254
L	ASN449
L	LYS451
L	ASP543
L	GLU564
L	GLN567
L	HOH873

site_id	MC3
Number of Residues	3
Details	BINDING SITE FOR RESIDUE 1PE L 619

Chain	Residue
G	TRP526
G	HOH657
L	HOH633

site_id	MC4
Number of Residues	4
Details	BINDING SITE FOR RESIDUE 1PE L 620

Chain	Residue
L	TYR103
L	ASN104
L	GLU316
L	LYS320

Functional Information from PROSITE/UniProt

site_id	PS00631
Number of Residues	8
Details	CYTOSOL_AP Cytosol aminopeptidase signature. NTDAEGRL

Chain	Residue	Details
A	ASN457-LEU464

Functional Information from SwissProt/UniProt

site_id	SWS_FT_FI1
Number of Residues	204
Details	Region: {"description":"L13 loop","evidences":[{"source":"PubMed","id":"35691342","evidenceCode":"ECO:0000269"}]}

Chain

Residue

Details

site_id	SWS_FT_FI2
Number of Residues	24
Details	Active site: {"evidences":[{"source":"UniProtKB","id":"P00727","evidenceCode":"ECO:0000250"}]}

Chain

Residue

Details

site_id	SWS_FT_FI3
Number of Residues	36
Details	Binding 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"}]}

Chain

Residue

Details

site_id	SWS_FT_FI4
Number of Residues	12
Details	Binding 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"}]}

Chain

Residue

Details

site_id	SWS_FT_FI5
Number of Residues	36
Details	Binding site: {"evidences":[{"source":"PubMed","id":"35691342","evidenceCode":"ECO:0000269"},{"source":"PDB","id":"7SRV","evidenceCode":"ECO:0007744"}]}

Chain

Residue

Details

site_id	SWS_FT_FI6
Number of Residues	12
Details	Binding 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"}]}

Chain

Residue

Details

site_id	SWS_FT_FI7
Number of Residues	12
Details	Site: {"description":"Essential for hexamer stabilization","evidences":[{"source":"PubMed","id":"35691342","evidenceCode":"ECO:0000269"}]}

Chain

Residue

Details

		Sequence (fasta)
		PDBx/mmCIF
		PDBML format (no-atom)
		PDB format (full)
		Validation report (PDF)
		EDMap 2fo-fc (MTZ)