Summary Structural details Experimental details Functional details Sequence Neighbor History Downloads

4A51

Crystal structure of human kinesin Eg5 in complex with 1-(3-(((2-Aminoethyl)thio)diphenylmethyl)phenyl)ethanone hydrochloride

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
C	0003777	molecular_function	microtubule motor activity
C	0005524	molecular_function	ATP binding
C	0007018	biological_process	microtubule-based movement
C	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
F	0003777	molecular_function	microtubule motor activity
F	0005524	molecular_function	ATP binding
F	0007018	biological_process	microtubule-based movement
F	0008017	molecular_function	microtubule binding
G	0003777	molecular_function	microtubule motor activity
G	0005524	molecular_function	ATP binding
G	0007018	biological_process	microtubule-based movement
G	0008017	molecular_function	microtubule binding

Functional Information from PDB Data

site_id	AC1
Number of Residues	11
Details	BINDING SITE FOR RESIDUE ADP A 601

Chain	Residue
A	ARG24
A	HOH2014
A	HOH2032
A	ARG26
A	GLY108
A	GLY110
A	LYS111
A	THR112
A	PHE113
A	GLU118
A	MG701

site_id	AC2
Number of Residues	7
Details	BINDING SITE FOR RESIDUE MG A 701

Chain	Residue
A	THR112
A	ASP265
A	ADP601
A	HOH2012
A	HOH2013
A	HOH2014
A	HOH2032

site_id	AC3
Number of Residues	11
Details	BINDING SITE FOR RESIDUE DQ8 A 801

Chain	Residue
A	THR112
A	GLU116
A	GLY117
A	GLU118
A	ARG119
A	ILE136
A	PRO137
A	LEU160
A	TYR211
A	ALA218
A	ARG221

site_id	AC4
Number of Residues	13
Details	BINDING SITE FOR RESIDUE ADP B 601

Chain	Residue
B	ARG24
B	PRO27
B	THR107
B	GLY108
B	THR109
B	GLY110
B	LYS111
B	THR112
B	PHE113
B	GLU118
B	MG701
B	HOH2008
B	HOH2009

site_id	AC5
Number of Residues	4
Details	BINDING SITE FOR RESIDUE MG B 701

Chain	Residue
B	THR112
B	ADP601
B	HOH2008
B	HOH2009

site_id	AC6
Number of Residues	11
Details	BINDING SITE FOR RESIDUE DQ8 B 801

Chain	Residue
B	GLU116
B	GLY117
B	GLU118
B	ALA133
B	ILE136
B	PRO137
B	LEU160
B	TYR211
B	LEU214
B	ALA218
B	ARG221

site_id	AC7
Number of Residues	14
Details	BINDING SITE FOR RESIDUE ADP C 601

Chain	Residue
C	ARG24
C	ARG26
C	PRO27
C	GLY108
C	THR109
C	GLY110
C	LYS111
C	THR112
C	PHE113
C	GLU118
C	MG701
C	HOH2021
G	THR226
G	LEU227

site_id	AC8
Number of Residues	4
Details	BINDING SITE FOR RESIDUE MG C 701

Chain	Residue
C	THR112
C	ADP601
C	HOH2020
C	HOH2021

site_id	AC9
Number of Residues	9
Details	BINDING SITE FOR RESIDUE DQ8 C 801

Chain	Residue
C	THR112
C	GLU116
C	GLY117
C	GLU118
C	ARG119
C	ILE136
C	PRO137
C	LEU160
C	TYR211

site_id	BC1
Number of Residues	14
Details	BINDING SITE FOR RESIDUE ADP D 601

Chain	Residue
D	ARG24
D	PRO27
D	THR107
D	GLY108
D	THR109
D	GLY110
D	LYS111
D	THR112
D	PHE113
D	GLU118
D	MG701
D	HOH2009
D	HOH2015
D	HOH2030

site_id	BC2
Number of Residues	5
Details	BINDING SITE FOR RESIDUE MG D 701

Chain	Residue
D	ASP265
D	ADP601
D	HOH2015
D	HOH2030
D	THR112

site_id	BC3
Number of Residues	9
Details	BINDING SITE FOR RESIDUE DQ8 D 801

Chain	Residue
D	GLU116
D	GLY117
D	GLU118
D	ILE136
D	PRO137
D	LEU160
D	TYR211
D	LEU214
D	ALA218

site_id	BC4
Number of Residues	12
Details	BINDING SITE FOR RESIDUE ADP E 601

Chain	Residue
E	ARG24
E	ARG26
E	PRO27
E	THR107
E	GLY108
E	GLY110
E	LYS111
E	THR112
E	PHE113
E	GLU118
E	MG701
E	HOH2010

site_id	BC5
Number of Residues	4
Details	BINDING SITE FOR RESIDUE MG E 701

Chain	Residue
E	THR112
E	ADP601
E	HOH2010
E	HOH2011

site_id	BC6
Number of Residues	11
Details	BINDING SITE FOR RESIDUE DQ8 E 801

Chain	Residue
E	GLU116
E	GLY117
E	GLU118
E	ARG119
E	ALA133
E	PRO137
E	LEU160
E	TYR211
E	LEU214
E	GLU215
E	ALA218

site_id	BC7
Number of Residues	12
Details	BINDING SITE FOR RESIDUE ADP F 601

Chain	Residue
F	ARG24
F	PRO27
F	GLY108
F	THR109
F	GLY110
F	LYS111
F	THR112
F	PHE113
F	GLU118
F	MG701
F	HOH2008
F	HOH2010

site_id	BC8
Number of Residues	5
Details	BINDING SITE FOR RESIDUE MG F 701

Chain	Residue
F	THR112
F	ADP601
F	HOH2008
F	HOH2009
F	HOH2010

site_id	BC9
Number of Residues	10
Details	BINDING SITE FOR RESIDUE DQ8 F 801

Chain	Residue
F	GLY117
F	GLU118
F	ARG119
F	ILE136
F	PRO137
F	LEU160
F	TYR211
F	LEU214
F	GLU215
F	ALA218

site_id	CC1
Number of Residues	14
Details	BINDING SITE FOR RESIDUE ADP G 601

Chain	Residue
C	HOH2025
G	ARG24
G	ARG26
G	PRO27
G	GLN106
G	THR107
G	GLY108
G	THR109
G	GLY110
G	LYS111
G	THR112
G	PHE113
G	GLU118
G	MG701

site_id	CC2
Number of Residues	5
Details	BINDING SITE FOR RESIDUE MG G 701

Chain	Residue
C	HOH2025
G	THR112
G	ADP601
G	HOH2008
G	HOH2009

site_id	CC3
Number of Residues	11
Details	BINDING SITE FOR RESIDUE DQ8 G 801

Chain	Residue
C	GLU124
C	TYR125
G	GLU116
G	GLY117
G	PRO137
G	LEU160
G	TYR211
G	LEU214
G	GLU215
G	ALA218
G	ARG221

site_id	CC4
Number of Residues	5
Details	BINDING SITE FOR RESIDUE SO4 D 1362

Chain	Residue
C	ARG47
D	GLU42
D	CYS43
D	ALA74
D	HOH2002

site_id	CC5
Number of Residues	2
Details	BINDING SITE FOR RESIDUE CL A 1364

Chain	Residue
A	PHE185
A	ASP186

site_id	CC6
Number of Residues	2
Details	BINDING SITE FOR RESIDUE CL A 1365

Chain	Residue
A	HIS354
A	HOH2031

site_id	CC7
Number of Residues	2
Details	BINDING SITE FOR RESIDUE CL A 1366

Chain	Residue
A	GLU129
A	ARG138

site_id	CC8
Number of Residues	2
Details	BINDING SITE FOR RESIDUE CL A 1367

Chain	Residue
A	CYS43
A	HOH2007

site_id	CC9
Number of Residues	1
Details	BINDING SITE FOR RESIDUE CL B 1365

Chain	Residue
B	ASP186

site_id	DC1
Number of Residues	2
Details	BINDING SITE FOR RESIDUE CL C 1367

Chain	Residue
C	CYS43
C	CL1368

site_id	DC2
Number of Residues	1
Details	BINDING SITE FOR RESIDUE CL C 1368

Chain	Residue
C	CL1367

site_id	DC3
Number of Residues	1
Details	BINDING SITE FOR RESIDUE CL C 1369

Chain	Residue
C	HIS354

site_id	DC4
Number of Residues	3
Details	BINDING SITE FOR RESIDUE CL D 1363

Chain	Residue
D	ASP186
D	ARG318
D	HOH2037

site_id	DC5
Number of Residues	1
Details	BINDING SITE FOR RESIDUE CL D 1364

Chain	Residue
D	LEU30

site_id	DC6
Number of Residues	2
Details	BINDING SITE FOR RESIDUE CL E 1364

Chain	Residue
E	CYS43
E	GLY73

site_id	DC7
Number of Residues	1
Details	BINDING SITE FOR RESIDUE CL G 1364

Chain	Residue
G	ASN229

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	7
Details	BINDING: BINDING => ECO:0000255\|PROSITE-ProRule:PRU00283

Chain	Residue	Details
A	GLY105
B	GLY105
C	GLY105
D	GLY105
E	GLY105
F	GLY105
G	GLY105

site_id	SWS_FT_FI2
Number of Residues	7
Details	MOD_RES: N6-acetyllysine => ECO:0007744\|PubMed:19608861

Chain	Residue	Details
A	LYS146
B	LYS146
C	LYS146
D	LYS146
E	LYS146
F	LYS146
G	LYS146

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