Indeed they have been observed in quite a number of high resolution structures.

http://www.ruppweb.org/Garland/gallery/Ch12/pages/Biomolecular_Crystallography_Fig_12-28.htm

 

Chees, BR

 

From: CCP4 bulletin board <[email protected]> On Behalf Of Ronald E. 
Stenkamp
Sent: Friday, September 27, 2019 17:22
To: [email protected]
Subject: Re: [ccp4bb] Reg: water pentagon at dimer interface

 

I don’t know about the myth thing, but I remember Martha Teeter describing 
pentagons of waters in crambin.

 

Here’s a reference:

 

Water Structure of a Hydrophobic Protein at Atomic Resolution: Pentagon Rings 
of WaterMolecules in Crystals of Crambin      M. M. Teeter      Proceedings of 
the National Academy of Sciences of the United States of America, 1984, 81(1), 
6014-6018.

 

Ron 

 

From: CCP4 bulletin board <[email protected] <mailto:[email protected]> 
> On Behalf Of Vijaykumar Pillalamarri
Sent: Friday, September 27, 2019 4:34 AM
To: [email protected] <mailto:[email protected]> 
Subject: [ccp4bb] Reg: water pentagon at dimer interface

 

Dear Community,

 

I solved the structure of a protein from vibrio. There are two molecules in the 
asymmetric unit of this protein. At the dimer interface, the C-termini of both 
the chains interact with each other with the help of five water molecules that 
form a pentagon. I have attached an image showing both the chains and stereo 
image of dimer interface in the inset. I was wondering if there is any 
significance to this or if there is any relevant literature that explains this 
behavior.

 

Thank you

Vijaykumar Pillalamarri

C/O: Dr. Anthony Addlagatta

Principal Scientist

CSIR-IICT, Tarnaka

Hyderabad, India-500007

Mobile: +918886922975

 

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