5HTC

Crystal structure of haspin (GSG2) in complex with bisubstrate inhibitor ARC-3372

Functional Information from GO Data

Chain	GOid	namespace	contents
A	0004672	molecular_function	protein kinase activity
A	0005524	molecular_function	ATP binding
A	0006468	biological_process	protein phosphorylation

Functional Information from PDB Data

site_id	AC1
Number of Residues	5
Details	binding site for residue MPD A 801

Chain	Residue
A	GLU728
A	TYR739
A	LEU782
A	ASN783
A	PHE784

---

site_id	AC2
Number of Residues	4
Details	binding site for residue MPD A 802

Chain	Residue
A	PRO571
A	ARG695
A	ILE698
A	HOH1118

---

site_id	AC3
Number of Residues	6
Details	binding site for residue NA A 803

Chain	Residue
A	GLU554
A	PHE556
A	SER684
A	HOH906
A	HOH938
A	HOH1159

---

site_id	AC4
Number of Residues	4
Details	binding site for residue DMS A 804

Chain	Residue
A	TYR667
A	LYS672
A	SER674
A	HOH910

---

site_id	AC5
Number of Residues	32
Details	binding site for residue 66M C 101

Chain	Residue
A	ILE490
A	GLY491
A	GLU492
A	GLY493
A	VAL494
A	PHE495
A	GLY496
A	ALA509
A	ILE557
A	GLU606
A	PHE607
A	GLY608
A	GLY609
A	ASP611
A	GLY653
A	LEU656
A	ILE686
A	ASP687
A	THR689
A	HOH933
A	HOH935
A	HOH937
A	HOH940
A	HOH1053
C	ARG2
C	LYS3
C	HOH202
C	HOH203
C	HOH206
C	HOH211
C	HOH212
C	HOH215

---

site_id	AC6
Number of Residues	2
Details	binding site for Ligand 66N C 7 bound to THR C 6

Chain	Residue
C	GLN5
C	THR6

---

Functional Information from PROSITE/UniProt

site_id	PS00107
Number of Residues	22
Details	PROTEIN_KINASE_ATP Protein kinases ATP-binding region signature. IGEGVFGEVFqTiadhtp............VAIK

Chain	Residue	Details
A	ILE490-LYS511

---

Functional Information from SwissProt/UniProt

site_id	SWS_FT_FI1
Number of Residues	314
Details	Domain: {"description":"Protein kinase","evidences":[{"source":"PROSITE-ProRule","id":"PRU00159","evidenceCode":"ECO:0000255"},{"evidenceCode":"ECO:0000305"}]}

Chain

Residue

Details

---

site_id	SWS_FT_FI2
Number of Residues	1
Details	Active site: {"description":"Proton acceptor","evidences":[{"source":"PROSITE-ProRule","id":"PRU00159","evidenceCode":"ECO:0000255"}]}

Chain

Residue

Details

---

site_id	SWS_FT_FI3
Number of Residues	9
Details	Binding site: {"evidences":[{"source":"PROSITE-ProRule","id":"PRU00159","evidenceCode":"ECO:0000255"}]}

Chain

Residue

Details

---

site_id	SWS_FT_FI4
Number of Residues	10
Details	Binding site: {"evidences":[{"source":"PubMed","id":"19918057","evidenceCode":"ECO:0000269"},{"source":"PDB","id":"3DLZ","evidenceCode":"ECO:0007744"}]}

Chain

Residue

Details

---

site_id	SWS_FT_FI5
Number of Residues	2
Details	Binding site: {"evidences":[{"source":"PubMed","id":"19918057","evidenceCode":"ECO:0000269"}]}

Chain

Residue

Details

---