3QXQ

structure of the bacterial cellulose synthase subunit z in complex with cellopentaose

• Total interactions analyzed: 6
• Total true interactions: 4
• Strongest Interaction:
  • Chains: C-D
  • Int. Res.: 90
  • Norm. En. per Res.: -4.1577
• 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	-42.9587	-70.2865	-226.187	-339.4321	85	11	0	8111	14	35	40
A-C	-4.1296	-39.2253	-100.539	-143.8939	73	4	0	4681	2	38	31
B-D	-2.8397	-39.3211	-104.791	-146.9518	76	4	0	4854	4	38	31
C-D	-49.2546	-97.3823	-227.559	-374.1959	90	16	0	8591	16	36	43

Interface residues

• A-B: ALA27A, ALA27B, ALA313A, ALA313B, ALA315A, ALA315B, ALA322A, ALA322B, ARG311A, ARG311B, ARG318A, ARG318B, ARG320A, ARG320B, ARG347A, ARG347B, ARG349A, ARG349B, ASN310A, ASN310B, ASN324A, ASN324B, ASP256A, ASP256B, ASP312A, ASP312B, ASP323A, ASP323B, ASP344A, ASP344B, ASP359A, ASP359B, CYS23A, CYS23B, GLN309A, GLN309B, GLN314A, GLN314B, GLN317A, GLN317B, GLN319A, GLN319B, GLN341A, GLN341B, GLN345A, GLN345B, GLY252B, GLY340B, GLY342A, GLY342B, HIS346A, HIS346B, LEU305A, LEU305B, LEU308A, LEU308B, LEU357A, LEU357B, LYS261A, LYS261B, MET304B, PHE307A, PHE307B, PHE325A, PHE325B, PHE348A, PHE348B, PRO255A, PRO255B, PRO26A, PRO26B, PRO306A, PRO306B, THR24A, THR24B, TRP25A, TRP25B, TRP343A, TRP343B, TRP360A, TRP360B, VAL316A, VAL316B, VAL321A, VAL321B
• A-C: ALA48A, ALA71C, ARG136A, ARG136C, ARG41A, ARG41C, ARG49A, ARG49C, ASN103A, ASN103C, ASN75A, ASN75C, ASN82A, ASN82C, ASN83A, ASN83C, ASP329C, ASP34A, ASP34C, ASP44A, ASP44C, ASP47A, ASP74A, ASP74C, ASP78A, ASP78C, GLN38A, GLN38C, GLN81A, GLN81C, GLN86A, GLN86C, GLU39A, GLU39C, GLY40A, GLY40C, GLY87A, GLY87C, GLY99A, GLY99C, ILE36C, ILE43A, ILE43C, ILE51A, ILE76C, LEU77C, LYS100A, LYS100C, LYS105A, LYS105C, LYS33A, LYS33C, LYS50A, LYS50C, PRO45A, PRO45C, SER104A, SER104C, SER328A, SER328C, SER37A, SER37C, SER46C, THR52A, THR52C, TRP106A, TRP106C, TRP79A, TRP79C, TRP98A, TRP98C, TYR35A, TYR35C
• B-D: ARG136B, ARG136D, ARG41B, ARG41D, ARG49B, ARG49D, ASN103B, ASN103D, ASN75B, ASN75D, ASN82B, ASN82D, ASN83B, ASN83D, ASP329B, ASP329D, ASP34B, ASP34D, ASP44B, ASP44D, ASP47B, ASP74B, ASP74D, ASP78B, ASP78D, GLN30B, GLN30D, GLN38B, GLN38D, GLN81B, GLN81D, GLN86B, GLN86D, GLU39B, GLU39D, GLY40B, GLY40D, GLY87B, GLY87D, GLY99B, GLY99D, ILE36B, ILE36D, ILE43B, ILE43D, ILE51D, LEU77B, LEU77D, LYS100B, LYS100D, LYS101B, LYS105B, LYS105D, LYS33B, LYS33D, LYS50B, LYS50D, PRO45B, PRO45D, SER104B, SER104D, SER328B, SER328D, SER37B, SER37D, SER46B, SER46D, SER88D, TRP106B, TRP106D, TRP79B, TRP79D, TRP98B, TRP98D, TYR35B, TYR35D
• C-D: ALA27C, ALA27D, ALA313C, ALA313D, ALA315C, ALA315D, ALA322C, ALA322D, ARG311C, ARG311D, ARG318C, ARG318D, ARG320C, ARG320D, ARG347C, ARG347D, ARG349C, ARG349D, ASN310C, ASN310D, ASN324C, ASN324D, ASP256C, ASP256D, ASP312C, ASP312D, ASP323C, ASP323D, ASP344C, ASP344D, ASP359C, ASP359D, CYS23C, CYS23D, GLN309C, GLN309D, GLN314C, GLN314D, GLN317C, GLN317D, GLN319C, GLN319D, GLN341C, GLN341D, GLN345C, GLN345D, GLY252C, GLY252D, GLY340D, GLY342C, GLY342D, HIS346C, HIS346D, LEU265C, LEU305C, LEU305D, LEU308C, LEU308D, LEU357C, LEU357D, LYS261C, LYS261D, MET253D, MET304C, MET304D, PHE307C, PHE307D, PHE325C, PHE348C, PHE348D, PHE350C, PHE350D, PRO255C, PRO255D, PRO26C, PRO26D, PRO306C, PRO306D, THR24C, THR24D, TRP25C, TRP25D, TRP343C, TRP343D, TRP360C, TRP360D, VAL316C, VAL316D, VAL321C, VAL321D