Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "3499546980c9a07c46076648e18c4b53",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 39.61,
"b": 63.50,
"c": 75.44,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.91837,0.97947],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [29.260,1.15],
"number_observations_unique": 68022,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.037
},
{
"type": "I/SigI",
"value": 11.430
},
{
"type": "Completeness",
"value": 98.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.19,1.15],
"number_observations": 21233,
"number_observations_unique": 11988,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.378
},
{
"type": "I/SigI",
"value": 2.3
},
{
"type": "Completeness",
"value": 94.20
}
]
},
{
"resolution_limits": [1.24,1.19],
"number_observations": 24047,
"number_observations_unique": 13355,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.323
},
{
"type": "I/SigI",
"value": 2.7
},
{
"type": "Completeness",
"value": 97.20
}
]
},
{
"resolution_limits": [1.30,1.24],
"number_observations": 24546,
"number_observations_unique": 13447,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.275
},
{
"type": "I/SigI",
"value": 3.2
},
{
"type": "Completeness",
"value": 97.80
}
]
},
{
"resolution_limits": [1.36,1.30],
"number_observations": 20933,
"number_observations_unique": 11314,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.217
},
{
"type": "I/SigI",
"value": 4.0
},
{
"type": "Completeness",
"value": 98.50
}
]
},
{
"resolution_limits": [1.45,1.36],
"number_observations": 25355,
"number_observations_unique": 13606,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.167
},
{
"type": "I/SigI",
"value": 5.1
},
{
"type": "Completeness",
"value": 98.80
}
]
},
{
"resolution_limits": [1.56,1.45],
"number_observations": 23864,
"number_observations_unique": 12743,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.110
},
{
"type": "I/SigI",
"value": 7.4
},
{
"type": "Completeness",
"value": 98.80
}
]
},
{
"resolution_limits": [1.72,1.56],
"number_observations": 24887,
"number_observations_unique": 13143,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.074
},
{
"type": "I/SigI",
"value": 10.3
},
{
"type": "Completeness",
"value": 99.00
}
]
},
{
"resolution_limits": [1.97,1.72],
"number_observations": 24434,
"number_observations_unique": 12903,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.046
},
{
"type": "I/SigI",
"value": 15.0
},
{
"type": "Completeness",
"value": 98.70
}
]
},
{
"resolution_limits": [2.48,1.97],
"number_observations": 35406,
"number_observations_unique": 12884,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.038
},
{
"type": "I/SigI",
"value": 24.2
},
{
"type": "Completeness",
"value": 99.30
}
]
},
{
"resolution_limits": [29.260,2.48],
"number_observations": 49418,
"number_observations_unique": 12763,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.025
},
{
"type": "I/SigI",
"value": 39.8
},
{
"type": "Completeness",
"value": 97.80
}
]
}
]
}