2GM1

Crystal structure of the mitotic kinesin eg5 in complex with mg-adp and n-(3-aminopropyl)-n-((3-benzyl-5-chloro-4-oxo-3,4-dihydropyrrolo[2,1-f][1,2,4]triazin-2-yl)(cyclopropyl)methyl)-4-methylbenzamide

Functional Information from GO Data

Chain	GOid	namespace	contents
A	0003777	molecular_function	microtubule motor activity
A	0005524	molecular_function	ATP binding
A	0007018	biological_process	microtubule-based movement
A	0008017	molecular_function	microtubule binding
B	0003777	molecular_function	microtubule motor activity
B	0005524	molecular_function	ATP binding
B	0007018	biological_process	microtubule-based movement
B	0008017	molecular_function	microtubule binding
D	0003777	molecular_function	microtubule motor activity
D	0005524	molecular_function	ATP binding
D	0007018	biological_process	microtubule-based movement
D	0008017	molecular_function	microtubule binding
E	0003777	molecular_function	microtubule motor activity
E	0005524	molecular_function	ATP binding
E	0007018	biological_process	microtubule-based movement
E	0008017	molecular_function	microtubule binding

Functional Information from PDB Data

site_id	AC1
Number of Residues	6
Details	BINDING SITE FOR RESIDUE MG A 369

Chain	Residue
A	THR112
A	ADP372
A	HOH373
A	HOH374
A	HOH375
A	HOH376

---

site_id	AC2
Number of Residues	6
Details	BINDING SITE FOR RESIDUE MG B 369

Chain	Residue
B	HOH374
B	HOH375
B	HOH376
B	THR112
B	ADP372
B	HOH373

---

site_id	AC3
Number of Residues	6
Details	BINDING SITE FOR RESIDUE MG D 369

Chain	Residue
D	THR112
D	ADP372
D	HOH373
D	HOH374
D	HOH375
D	HOH376

---

site_id	AC4
Number of Residues	6
Details	BINDING SITE FOR RESIDUE MG E 369

Chain	Residue
E	THR112
E	ADP372
E	HOH373
E	HOH374
E	HOH375
E	HOH376

---

site_id	AC5
Number of Residues	3
Details	BINDING SITE FOR RESIDUE MG A 370

Chain	Residue
A	SER232
A	SER235
A	HOH379

---

site_id	AC6
Number of Residues	4
Details	BINDING SITE FOR RESIDUE MG B 370

Chain	Residue
B	SER232
B	SER235
B	HOH385
B	HOH407

---

site_id	AC7
Number of Residues	4
Details	BINDING SITE FOR RESIDUE MG D 370

Chain	Residue
D	SER232
D	SER235
D	HOH380
D	HOH389

---

site_id	AC8
Number of Residues	4
Details	BINDING SITE FOR RESIDUE MG E 370

Chain	Residue
E	SER232
E	SER235
E	HOH389
E	HOH410

---

site_id	AC9
Number of Residues	11
Details	BINDING SITE FOR RESIDUE 2AZ A 371

Chain	Residue
A	GLU116
A	GLY117
A	GLU118
A	TRP127
A	ILE136
A	LEU160
A	TYR211
A	LEU214
A	GLU215
A	ARG221
A	HOH433

---

site_id	BC1
Number of Residues	12
Details	BINDING SITE FOR RESIDUE 2AZ B 371

Chain	Residue
B	GLU116
B	GLY117
B	GLU118
B	TRP127
B	ILE136
B	PRO137
B	LEU160
B	TYR211
B	LEU214
B	GLU215
B	ARG221
B	HOH414

---

site_id	BC2
Number of Residues	12
Details	BINDING SITE FOR RESIDUE 2AZ D 371

Chain	Residue
D	GLU116
D	GLY117
D	GLU118
D	ARG119
D	TRP127
D	ILE136
D	LEU160
D	TYR211
D	LEU214
D	GLU215
D	ARG221
D	HOH424

---

site_id	BC3
Number of Residues	11
Details	BINDING SITE FOR RESIDUE 2AZ E 371

Chain	Residue
E	GLU116
E	GLY117
E	GLU118
E	TRP127
E	ILE136
E	LEU160
E	TYR211
E	LEU214
E	GLU215
E	ARG221
E	HOH425

---

site_id	BC4
Number of Residues	18
Details	BINDING SITE FOR RESIDUE ADP A 372

Chain	Residue
A	HOH391
A	HOH397
E	LEU30
E	LYS34
A	PRO27
A	THR107
A	GLY108
A	THR109
A	GLY110
A	LYS111
A	THR112
A	PHE113
A	GLU118
A	MG369
A	HOH373
A	HOH375
A	HOH376
A	HOH388

---

site_id	BC5
Number of Residues	16
Details	BINDING SITE FOR RESIDUE ADP B 372

Chain	Residue
B	PRO27
B	THR107
B	GLY108
B	THR109
B	GLY110
B	LYS111
B	THR112
B	PHE113
B	GLU118
B	MG369
B	HOH375
B	HOH376
B	HOH387
B	HOH399
D	LEU30
D	LYS34

---

site_id	BC6
Number of Residues	17
Details	BINDING SITE FOR RESIDUE ADP D 372

Chain	Residue
B	LEU30
B	LYS34
D	PRO27
D	THR107
D	GLY108
D	THR109
D	GLY110
D	LYS111
D	THR112
D	PHE113
D	GLU118
D	MG369
D	HOH375
D	HOH376
D	HOH395
D	HOH407
D	HOH423

---

site_id	BC7
Number of Residues	15
Details	BINDING SITE FOR RESIDUE ADP E 372

Chain	Residue
A	LEU30
A	LYS34
E	PRO27
E	THR107
E	GLY108
E	THR109
E	GLY110
E	LYS111
E	THR112
E	PHE113
E	GLU118
E	MG369
E	HOH375
E	HOH376
E	HOH430

---

Functional Information from PROSITE/UniProt

site_id	PS00411
Number of Residues	12
Details	KINESIN_MOTOR_1 Kinesin motor domain signature. GKLnLVDLAGSE

Chain	Residue	Details
A	GLY259-GLU270

---

Functional Information from SwissProt/UniProt

site_id	SWS_FT_FI1
Number of Residues	28
Details	Binding site: {"evidences":[{"source":"PROSITE-ProRule","id":"PRU00283","evidenceCode":"ECO:0000255"}]}

Chain

Residue

Details

---

site_id	SWS_FT_FI2
Number of Residues	4
Details	Modified residue: {"description":"N6-acetyllysine","evidences":[{"source":"PubMed","id":"19608861","evidenceCode":"ECO:0007744"}]}

Chain

Residue

Details

---

Catalytic Information from CSA

site_id	CSA1
Number of Residues	1
Details	Annotated By Reference To The Literature 1goj

Chain	Residue	Details
A	GLY268

---

site_id	CSA2
Number of Residues	1
Details	Annotated By Reference To The Literature 1goj

Chain	Residue	Details
B	GLY268

---

site_id	CSA3
Number of Residues	1
Details	Annotated By Reference To The Literature 1goj

Chain	Residue	Details
D	GLY268

---

site_id	CSA4
Number of Residues	1
Details	Annotated By Reference To The Literature 1goj

Chain	Residue	Details
E	GLY268

---