3R45

structure of a cenp-a-histone h4 heterodimer in complex with chaperone hjurp

• Total interactions analyzed: 3
• Total true interactions: 3
• Strongest Interaction:
  • Chains: A-C
  • Int. Res.: 105
  • Norm. En. per Res.: -5.0295
• Hub Node: A(2)

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-B	-73.5627	-25.9527	-547.16	-646.6754	139	14	42	23821	1	41	37
A-C	-62.2509	-96.362	-369.482	-528.0949	105	11	13	13932	5	35	27
B-C	0.0	0.0	-72.3508	-72.3508	46	1	6	3218	0	3	7

Interface residues

• A-B: ALA100A, ALA109A, ALA33B, ALA38B, ALA69B, ALA71A, ALA83B, ALA88A, ALA89B, ALA90A, ALA93A, ALA97A, ALA98A, ARG118A, ARG130A, ARG133A, ARG23B, ARG35B, ARG36B, ARG39B, ARG40B, ARG45B, ARG55B, ARG63A, ARG67B, ARG69A, ARG72A, ARG78B, ARG80A, ARG95B, ASN25B, ASN64B, ASN85A, ASP108A, ASP125A, ASP24B, ASP68B, ASP83A, ASP85B, CYS75A, GLN127A, GLN27B, GLN87A, GLN89A, GLN93B, GLN95A, GLU107A, GLU137A, GLU52B, GLU53B, GLU63B, GLU73A, GLU74B, GLU96A, GLU99A, GLY134A, GLY138A, GLY28B, GLY41B, GLY42B, GLY48B, GLY56B, GLY94B, HIS104A, HIS59A, HIS75B, ILE26B, ILE29B, ILE34B, ILE46B, ILE50B, ILE62A, ILE66B, ILE74A, LEU102A, LEU105A, LEU111A, LEU114A, LEU121A, LEU128A, LEU37B, LEU49B, LEU58B, LEU60A, LEU61A, LEU62B, LEU65A, LEU70A, LEU90B, LEU91A, LEU92A, LEU94A, LYS124A, LYS44B, LYS59B, LYS64A, LYS77A, LYS77B, LYS79B, MET84B, PHE101A, PHE106A, PHE122A, PHE61B, PHE67A, PHE78A, PHE84A, PRO123A, PRO32B, PRO66A, SER47B, SER68A, THR113A, THR120A, THR30B, THR54B, THR71B, THR73B, THR79A, THR80B, THR82B, THR96B, TRP86A, TYR110A, TYR51B, TYR72B, VAL103A, VAL119A, VAL126A, VAL43B, VAL57B, VAL60B, VAL65B, VAL70B, VAL76A, VAL81B, VAL82A, VAL86B, VAL87B
• A-C: ALA100A, ALA109A, ALA116A, ALA129A, ALA24C, ALA53C, ALA71A, ALA88A, ALA90A, ALA93A, ALA97A, ALA98A, ARG133A, ARG23C, ARG26C, ARG27C, ARG28C, ARG32C, ARG35C, ARG63A, ARG64C, ARG69A, ARG69C, ARG72A, ASN41C, ASN85A, ASP108A, ASP15C, ASP16C, ASP46C, ASP83A, CYS75A, GLN17C, GLN20C, GLN30C, GLN42C, GLN51C, GLN87A, GLN89A, GLN95A, GLU107A, GLU136A, GLU137A, GLU14C, GLU45C, GLU73A, GLU96A, GLU99A, GLY117A, GLY140A, GLY67C, GLY68C, HIS104A, HIS115A, HIS59A, ILE132A, ILE37C, ILE65C, LEU102A, LEU105A, LEU111A, LEU112A, LEU114A, LEU128A, LEU18C, LEU19C, LEU22C, LEU36C, LEU55C, LEU60A, LEU65A, LEU70A, LEU91A, LEU92A, LEU94A, LYS21C, LYS39C, LYS64A, MET33C, MET52C, PHE101A, PHE106A, PHE29C, PHE44C, PHE67A, PHE84A, PRO43C, PRO48C, PRO66A, SER25C, SER68A, THR113A, THR47C, THR54C, THR56C, TRP66C, TRP86A, TYR110A, TYR40C, TYR57C, VAL103A, VAL49C, VAL50C, VAL76A, VAL82A
• B-C: ALA83B, ALA89B, ARG28C, ARG78B, ARG92B, ARG95B, ASN25B, ASN41C, ASP85B, GLN30C, GLN34C, GLN42C, GLN51C, GLN93B, GLU38C, GLU45C, GLY41B, GLY94B, ILE37C, ILE66B, LEU36C, LEU55C, LEU90B, LYS39C, LYS79B, LYS91B, MET33C, MET52C, MET84B, PHE29C, PHE44C, PHE61B, PRO43C, PRO48C, THR47C, THR80B, THR82B, TYR40C, TYR72B, TYR88B, VAL49C, VAL50C, VAL65B, VAL81B, VAL86B, VAL87B