3U5N

crystal structure of the complex of trim33 phd-bromo and h3(1-20) k9me3k14ac histone peptide

• Total interactions analyzed: 6
• Total true interactions: 5
• Strongest Interaction:
  • Chains: A-C
  • Int. Res.: 43
  • Norm. En. per Res.: -7.3762
• Hub Node: A(3)

All Interactions

Chains	Hydro. Bond Ener. (kJ/mol)	Elec. Ener. (kJ/mol)	VDW. Ener. (kJ/mol)	Tot. Stab. Ener. (kJ/mol)	#int. res.	# Short cont.	#Hydr. int.	#VDW pairs	#salt bridges	#Pot. fav. elec. int	#Pot. unfav. elec. int
A-C	-85.4742	-56.6143	-175.087	-317.1755	43	13	2	6188	3	16	8
A-B	0.0	-2.838	-24.7914	-27.6294	51	0	1	1676	2	19	12
A-D	-43.2558	5.1892	-17.458	-55.5246	24	9	0	1733	0	0	11
C-B	0.0	0.0	-0.5438	-0.5438	3	0	0	88	0	2	1
B-D	-86.2239	-59.88	-181.391	-327.4949	55	13	2	6408	3	21	9

Interface residues

• A-C: ALA1C, ALA7C, ARG2C, ARG8C, ASN886A, ASN895A, ASP884A, ASP888A, ASP898A, ASP925A, CYS890A, CYS893A, CYS901A, CYS902A, CYS905A, GLN5C, GLN894A, GLU887A, GLU903A, GLY896A, GLY897A, GLY924A, HIS910A, ILE927A, LEU899A, LEU900A, LEU911A, LEU918A, LYS4C, LYS904A, LYS907A, PHE909A, PHE921A, PRO885A, PRO906A, PRO922A, SER10C, SER923A, THR3C, THR6C, TRP889A, TRP926A, VAL908A
• A-B: ALA1058B, ALA1068B, ALA988A, ASN886B, ASN992A, ASP1059B, ASP883B, ASP884B, ASP942A, CYS905B, CYS931B, GLN1064B, GLU1061B, GLU1079B, GLU887B, GLU903B, GLU977B, GLU984A, HIS976B, ILE990A, LEU1071B, LEU911A, LEU918A, LEU919A, LEU978B, LYS1008A, LYS1013A, LYS1043B, LYS1067B, LYS1076B, LYS904B, LYS907B, LYS995A, LYS998A, PHE921A, PHE930B, PRO885B, PRO906B, PRO985A, PRO987A, PRO991A, SER1004A, SER1060B, SER920A, SER989A, THR912A, THR917A, TYR1072B, TYR972B, TYR993A, TYR994A
• A-D: ARG17D, ARG2D, ASP1002A, ASP1027A, GLN1016A, GLN19D, HIS1014A, HIS1017A, LEU1030A, LEU20D, LYS1008A, LYS1009A, LYS1013A, LYS18D, LYS995A, LYS999A, MET1001A, PRO1000A, PRO16D, SER1004A, SER1015A, THR1005A, TYR1018A, VAL1006A
• C-B: ARG8C, LEU1071B, LYS1067B
• B-D: ALA15D, ALA1D, ALA7D, ALA891B, ARG17D, ARG2D, ARG8D, ASN886B, ASN895B, ASP883B, ASP884B, ASP888B, ASP898B, ASP925B, CYS890B, CYS893B, CYS901B, CYS902B, CYS905B, CYS913B, GLN19D, GLN5D, GLN894B, GLU887B, GLU903B, GLU977B, GLY12D, GLY896B, GLY897B, GLY924B, HIS910B, ILE927B, LEU20D, LEU899B, LEU900B, LEU911B, LYS18D, LYS4D, LYS904B, LYS907B, PHE909B, PHE921B, PRO16D, PRO885B, PRO906B, PRO922B, SER10D, SER923B, THR11D, THR3D, THR6D, THR912B, TRP889B, TRP926B, VAL908B