Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "45852c6e43b9d941283153f82b20d004",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 64.349,
"b": 38.063,
"c": 81.217,
"alpha": 90.00,
"beta": 99.19,
"gamma": 90.00
},
"wavelengths": [1.08090],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [30.000,1.700],
"number_observations_unique": 41204,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.051
},
{
"type": "I/SigI",
"value": 14.800
},
{
"type": "Completeness",
"value": 94.800
},
{
"type": "Redundancy",
"value": 6.700
}
]
},
"refln_shells": [
{
"resolution_limits": [1.76,1.70],
"number_observations_unique": 2619,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.346
},
{
"type": "Completeness",
"value": 61.10
},
{
"type": "Redundancy",
"value": 3.40
}
]
},
{
"resolution_limits": [1.83,1.76],
"number_observations_unique": 3855,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.281
},
{
"type": "Completeness",
"value": 89.10
},
{
"type": "Redundancy",
"value": 5.10
}
]
},
{
"resolution_limits": [1.91,1.83],
"number_observations_unique": 4281,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.224
},
{
"type": "Completeness",
"value": 99.10
},
{
"type": "Redundancy",
"value": 6.60
}
]
},
{
"resolution_limits": [2.02,1.91],
"number_observations_unique": 4323,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.150
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 7.20
}
]
},
{
"resolution_limits": [2.14,2.02],
"number_observations_unique": 4345,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.115
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 7.30
}
]
},
{
"resolution_limits": [2.31,2.14],
"number_observations_unique": 4282,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.088
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 7.30
}
]
},
{
"resolution_limits": [2.54,2.31],
"number_observations_unique": 4350,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.070
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 7.30
}
]
},
{
"resolution_limits": [2.91,2.54],
"number_observations_unique": 4355,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.056
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 7.30
}
]
},
{
"resolution_limits": [3.66,2.91],
"number_observations_unique": 4374,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.044
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 7.10
}
]
},
{
"resolution_limits": [30.00,3.66],
"number_observations_unique": 4420,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.041
},
{
"type": "Completeness",
"value": 97.70
},
{
"type": "Redundancy",
"value": 6.80
}
]
}
]
}