Chemical Components in the PDB

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H2S : Summary

Code

H2S

One-letter code

X

Molecule name

HYDROSULFURIC ACID

Synonyms

HYDROGEN SULFIDE

Systematic names

ProgramVersionName
OpenEye OEToolkits 1.5.0 sulfane

Formula

H2 S

Formal charge

0

Molecular weight

34.081 Da

SMILES

TypeProgramVersionDescriptor
SMILES CACTVS 3.341 S
SMILES OpenEye OEToolkits 1.5.0 S
Canonical SMILES CACTVS 3.341 S
Canonical SMILES OpenEye OEToolkits 1.5.0 S

IUPAC InChI

InChI=1S/H2S/h1H2

IUPAC InChI key

RWSOTUBLDIXVET-UHFFFAOYSA-N
H2S

wwPDB Information

Atom count

3 (1 without Hydrogen)

Polymer type

Bound ligand

Type description

NON-POLYMER

Type code

HETAIN

Is modified

No

Standard parent

Not Assigned

Defined at

1999-07-08

Last modified at

2020-06-17

Status

Released

Obsoleted

Not Assigned



H2S : Atoms of Molecule

Total Number of Atoms: 3
Record Atom Name Symbol PDB Name Stereochemistry Is Aromatic Is Leaving Atom Charge X-Coordinate Y-Coordinate Z-Coordinate
1 HS1 H 1HS N N N 0 0.813 0.0 -1.03
2 HS2 H 2HS N N N 0 0.813 0.0 1.03
3 S S S N N N 0 -0.051 0.0 0.0



H2S : Chemical Bonds

Total Number of Bonds: 2
Record First Atom Second Atom First Element Second Element Bond Order Type Bond Length Bond Stereochemistry Is Aromatic
1 S HS1 S H sing 1.34 N N
2 S HS2 S H sing 1.34 N N



H2S : Used in PDB Entries

Total Number of PDB Entries: 97
Ligand Code PDB Entry ID Type Total Distinct
H2S 1cao Open in New Window Bound ligand 1 1
H2S 1cc1 Open in New Window Bound ligand 1 1
H2S 1crm Open in New Window Bound ligand 1 1
H2S 1e3d Open in New Window Bound ligand 4 1
H2S 1moh Open in New Window Bound ligand 1 1
H2S 1vck Open in New Window Bound ligand 1 1
H2S 1yq9 Open in New Window Bound ligand 4 1
H2S 3git Open in New Window Bound ligand 6 1
H2S 3hyv Open in New Window Bound ligand 6 1
H2S 3hyw Open in New Window Bound ligand 6 1
H2S 3hyx Open in New Window Bound ligand 6 1
H2S 3iix Open in New Window Bound ligand 4 1
H2S 3iiz Open in New Window Bound ligand 2 1
H2S 3kpk Open in New Window Bound ligand 2 1
H2S 3mmb Open in New Window Bound ligand 1 1
H2S 3o3m Open in New Window Bound ligand 2 1
H2S 3o3n Open in New Window Bound ligand 2 1
H2S 3o3o Open in New Window Bound ligand 1 1
H2S 3p9q Open in New Window Bound ligand 4 1
H2S 3pq2 Open in New Window Bound ligand 4 1
H2S 3pq3 Open in New Window Bound ligand 4 1
H2S 3pq4 Open in New Window Bound ligand 4 1
H2S 3pq5 Open in New Window Bound ligand 4 1
H2S 3pq6 Open in New Window Bound ligand 4 1
H2S 3pq7 Open in New Window Bound ligand 4 1
H2S 3pq8 Open in New Window Bound ligand 4 1
H2S 3sx6 Open in New Window Bound ligand 4 1
H2S 3sxi Open in New Window Bound ligand 4 1
H2S 3sy4 Open in New Window Bound ligand 5 1
H2S 3syi Open in New Window Bound ligand 5 1
H2S 3szc Open in New Window Bound ligand 3 1
H2S 3szf Open in New Window Bound ligand 4 1
H2S 3szw Open in New Window Bound ligand 4 1
H2S 3t0k Open in New Window Bound ligand 4 1
H2S 3t14 Open in New Window Bound ligand 1 1
H2S 3t2y Open in New Window Bound ligand 1 1
H2S 3t2z Open in New Window Bound ligand 10 1
H2S 3t31 Open in New Window Bound ligand 3 1
H2S 3ze7 Open in New Window Bound ligand 1 1
H2S 3zea Open in New Window Bound ligand 1 1
H2S 4al2 Open in New Window Bound ligand 3 1
H2S 4az4 Open in New Window Bound ligand 1 1
H2S 4hpa Open in New Window Bound ligand 1 1
H2S 4jxc Open in New Window Bound ligand 2 1
H2S 4jy8 Open in New Window Bound ligand 1 1
H2S 4jyd Open in New Window Bound ligand 2 1
H2S 4jyf Open in New Window Bound ligand 1 1
H2S 4kl8 Open in New Window Bound ligand 2 1
H2S 4kn9 Open in New Window Bound ligand 2 1
H2S 4ko1 Open in New Window Bound ligand 2 1
H2S 4ko2 Open in New Window Bound ligand 2 1
H2S 4ko3 Open in New Window Bound ligand 2 1
H2S 4ko4 Open in New Window Bound ligand 2 1
H2S 4m65 Open in New Window Bound ligand 2 1
H2S 4ueq Open in New Window Bound ligand 6 1
H2S 4upv Open in New Window Bound ligand 1 1
H2S 4uql Open in New Window Bound ligand 1 1
H2S 4uqp Open in New Window Bound ligand 1 1
H2S 4wcx Open in New Window Bound ligand 2 1
H2S 4wq9 Open in New Window Bound ligand 1 1
H2S 5ff2 Open in New Window Bound ligand 2 1
H2S 5ff3 Open in New Window Bound ligand 2 1
H2S 5jsh Open in New Window Bound ligand 1 1
H2S 5jsk Open in New Window Bound ligand 1 1
H2S 5jsu Open in New Window Bound ligand 2 1
H2S 5jsy Open in New Window Bound ligand 1 1
H2S 5jt1 Open in New Window Bound ligand 1 1
H2S 5t5i Open in New Window Bound ligand 2 1
H2S 5t5m Open in New Window Bound ligand 1 1
H2S 5t61 Open in New Window Bound ligand 8 1
H2S 5ucu Open in New Window Bound ligand 3 1
H2S 5x2x Open in New Window Bound ligand 4 1
H2S 5x30 Open in New Window Bound ligand 1 1
H2S 5z7f Open in New Window Bound ligand 1 1
H2S 6fea Open in New Window Bound ligand 2 1
H2S 6i0r Open in New Window Bound ligand 4 1
H2S 6oib Open in New Window Bound ligand 4 1
H2S 6oic Open in New Window Bound ligand 2 1
H2S 6rtp Open in New Window Bound ligand 1 1
H2S 6ru9 Open in New Window Bound ligand 2 1
H2S 6ruc Open in New Window Bound ligand 1 1
H2S 6sdr Open in New Window Bound ligand 1 1
H2S 6sdv Open in New Window Bound ligand 1 1
H2S 6tg9 Open in New Window Bound ligand 2 1
H2S 6tga Open in New Window Bound ligand 2 1
H2S 6ug0 Open in New Window Bound ligand 6 1
H2S 6vxt Open in New Window Bound ligand 2 1
H2S 6z7r Open in New Window Bound ligand 2 1
H2S 6z8j Open in New Window Bound ligand 2 1
H2S 6z8m Open in New Window Bound ligand 1 1
H2S 6z8o Open in New Window Bound ligand 2 1
H2S 6z96 Open in New Window Bound ligand 2 1
H2S 6z9g Open in New Window Bound ligand 4 1
H2S 6z9o Open in New Window Bound ligand 2 1
H2S 6za1 Open in New Window Bound ligand 2 1
H2S 6zw9 Open in New Window Bound ligand 2 1
H2S 7ady Open in New Window Bound ligand 2 1